data_2mdv_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 2mdv _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.664 ' HB2' HD21 ' B' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 120.982 0.42 . . . . 0.0 111.968 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -96.0 118.99 33.7 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 4.5 tp -118.54 134.84 54.78 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.228 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -124.46 127.57 47.69 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.085 178.535 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.535 HD11 HG23 ' B' ' 30' ' ' ILE . 1.1 pt -152.91 -176.51 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 -97.03 93.15 6.42 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -177.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.655 HD12 HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -128.04 109.34 11.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 177.392 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.731 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 9.1 p -79.13 -176.29 5.05 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -43.39 -59.12 2.25 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 113.769 -1.559 . . . . 0.0 112.992 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -47.43 -26.25 1.29 Allowed 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.574 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 21.9 p -101.25 -29.41 12.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 8' ' ' SER . 43.6 mt -73.54 -40.68 63.79 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 178.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.99 -40.71 94.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.551 175.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.577 ' O ' ' HG3' ' A' ' 18' ' ' MET . 0.1 OUTLIER -52.8 -48.22 67.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.282 -1.326 . . . . 0.0 109.282 178.131 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.641 HD21 ' CG ' ' A' ' 29' ' ' MET . 15.6 mt -71.61 9.92 0.76 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.457 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -102.53 -48.62 4.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.561 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.457 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 30.3 mttm -72.25 -40.8 67.43 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.017 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.681 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 43.4 mtm -68.97 -63.81 0.99 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.714 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.643 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -47.46 -49.48 25.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.745 0.418 . . . . 0.0 111.676 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.421 ' HD3' ' O ' ' A' ' 16' ' ' GLU . 15.9 mtp85 . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 121.013 0.435 . . . . 0.0 111.627 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.643 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 95.5 mt . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 121.632 0.73 . . . . 0.0 111.561 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 m -114.01 166.05 11.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.335 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.9 -40.1 1.3 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.57 ' HA ' HD13 ' B' ' 5' ' ' ILE . 1.5 m -84.13 -54.2 4.99 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 111.532 0.197 . . . . 0.0 111.532 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.48 ' HB3' HD23 ' A' ' 24' ' ' LEU . 2.3 mm-40 -61.69 -10.74 9.31 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 120.722 0.296 . . . . 0.0 111.063 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.681 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.6 tpt -83.59 -47.32 11.41 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.69 1.233 . . . . 0.0 107.719 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.627 HG21 HD13 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -74.5 -31.53 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 CA-C-N 113.114 -1.857 . . . . 0.0 113.397 -178.167 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.54 -46.9 77.78 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.414 1.102 . . . . 0.0 108.555 177.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.2 t -58.97 -47.37 90.03 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.595 0 CA-C-N 112.752 -2.022 . . . . 0.0 111.048 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.696 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -48.8 -37.69 19.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.29 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.555 HD21 ' CB ' ' B' ' 33' ' ' ALA . 13.4 mt -77.98 -29.74 49.86 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.973 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -79.47 -16.14 56.59 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -125.44 14.98 8.26 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.488 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.4 OUTLIER -71.64 137.7 48.1 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.182 0 C-N-CA 123.383 0.673 . . . . 0.0 112.259 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.731 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.5 mpt_? . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.808 0.337 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -99.56 119.83 38.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.602 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.9 tp -130.95 135.03 47.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.412 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -117.88 128.84 55.22 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.547 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.57 HD13 ' HA ' ' A' ' 27' ' ' SER . 4.6 pt -147.77 178.65 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.468 ' O ' ' HB3' ' A' ' 27' ' ' SER . 73.8 t-105 -99.75 103.14 14.77 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -176.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.627 HD13 HG21 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -126.23 118.97 26.25 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 177.084 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.521 ' O ' ' HB3' ' B' ' 12' ' ' LEU . 0.3 OUTLIER -84.06 -161.49 0.55 Allowed 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.857 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.433 ' O ' HG21 ' B' ' 11' ' ' THR . 2.6 p-10 -61.53 -168.6 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.359 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . 0.47 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.9 tt0 37.65 41.59 0.32 Allowed 'General case' 0 C--N 1.345 0.373 0 C-N-CA 123.456 0.702 . . . . 0.0 112.771 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.661 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 11.5 t 177.32 -51.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.83 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.664 HD21 ' HB2' ' A' ' 1' ' ' ARG . 0.5 OUTLIER -67.49 -30.46 70.16 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 176.32 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -91.85 -38.64 12.21 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.424 177.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.661 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.1 t70 -44.39 -27.04 0.39 Allowed 'General case' 0 C--N 1.342 0.259 0 CA-C-N 114.438 -1.256 . . . . 0.0 111.045 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.657 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 33.2 mt -70.75 25.2 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 31.9 mt-10 -101.64 -55.75 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -75.18 -23.38 57.69 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.355 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.869 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 19.2 mtm -87.14 -22.28 25.44 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.102 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.739 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.72 -66.42 0.92 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.252 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.9 mtt-85 -58.13 -65.1 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.978 0.418 . . . . 0.0 111.854 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.11 -33.26 18.15 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.275 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.514 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.6 mm-40 -87.39 -9.41 54.84 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.423 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.14 -8.26 77.36 Favored Glycine 0 C--N 1.339 0.696 0 C-N-CA 120.705 -0.759 . . . . 0.0 111.762 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.739 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 78.1 mt -72.14 174.89 6.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.541 0.686 . . . . 0.0 111.495 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.5 p -120.2 166.04 13.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.547 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.97 -39.45 4.07 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m -83.82 -53.08 5.87 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 121.996 0.119 . . . . 0.0 111.205 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.33 -7.37 6.18 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.716 0.294 . . . . 0.0 110.737 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.869 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.4 tpt -87.09 -48.56 7.98 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 122.632 1.206 . . . . 0.0 107.968 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.655 HG22 HD12 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -75.81 -36.75 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.08 0 CA-C-N 112.988 -1.915 . . . . 0.0 112.926 -177.81 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.43 -46.17 87.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.313 1.054 . . . . 0.0 108.585 177.129 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.42 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -60.07 -44.68 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 CA-C-N 112.919 -1.946 . . . . 0.0 110.759 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.555 ' CB ' HD21 ' A' ' 34' ' ' LEU . . . -51.11 -39.48 56.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.352 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.553 HD11 HD23 ' A' ' 15' ' ' LEU . 12.9 mt -73.28 -30.34 63.35 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.318 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -76.5 -19.47 57.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -129.73 20.44 5.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.696 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -72.8 134.11 44.78 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.702 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 2.3 mmpt? . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.453 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.782 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.783 0.325 . . . . 0.0 111.479 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.516 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 98.1 m95 -70.85 163.96 26.28 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.635 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.9 tp -163.74 142.99 8.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.501 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -123.79 134.59 53.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.699 178.954 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.542 HG13 HD21 ' A' ' 7' ' ' LEU . 1.8 pt -150.05 179.3 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -95.9 92.66 6.62 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.636 HD11 HG21 ' B' ' 30' ' ' ILE . 1.5 mm? -122.91 114.61 20.68 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.534 ' O ' HD23 ' A' ' 12' ' ' LEU . 27.0 p -72.68 -179.58 3.14 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.421 0.629 . . . . 0.0 110.27 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -60.55 -160.48 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.379 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.481 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.87 43.27 0.27 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 123.634 0.773 . . . . 0.0 113.006 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.691 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t 177.44 -50.28 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.64 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.725 HD21 ' HD2' ' B' ' 1' ' ' ARG . 0.7 OUTLIER -70.84 -30.79 67.3 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -89.24 -37.93 14.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.566 -1.652 . . . . 0.0 107.936 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.691 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -50.61 -17.42 0.51 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.335 -1.302 . . . . 0.0 111.156 178.639 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.724 ' HB3' ' HG2' ' A' ' 29' ' ' MET . 49.1 mt -69.04 25.75 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 179.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.433 ' H ' ' C ' ' A' ' 14' ' ' ASP . 17.0 mm-40 -97.94 -54.27 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.32 -21.47 62.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.282 179.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.912 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 8.6 mtm -90.77 -23.05 20.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.709 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.711 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -101.13 -64.77 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.545 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 . . . . . 0 N--CA 1.469 0.5 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.146 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.711 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.9 mt . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 121.582 0.706 . . . . 0.0 111.485 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.5 p -117.57 168.18 10.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.455 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.5 mmmm -46.39 -39.77 10.97 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.602 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 2.3 m -84.56 -52.34 6.2 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.132 0.173 . . . . 0.0 111.408 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.432 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.3 mm-40 -62.55 -7.28 4.39 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.7 0.286 . . . . 0.0 110.738 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.912 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.8 tpt -87.1 -48.5 8.03 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 122.657 1.218 . . . . 0.0 107.97 177.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.674 ' CG2' HD13 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -76.12 -37.94 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.981 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.911 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.407 HD21 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -62.92 -45.22 93.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 122.335 1.064 . . . . 0.0 108.604 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -62.23 -42.9 97.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 112.85 -1.977 . . . . 0.0 111.328 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.599 ' CB ' HD22 ' B' ' 34' ' ' LEU . . . -50.39 -35.39 28.04 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.521 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.594 HD23 ' CB ' ' B' ' 33' ' ' ALA . 15.3 mt -76.45 -31.11 57.65 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.35 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -77.68 -16.49 58.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -126.57 16.85 7.56 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.505 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.3 OUTLIER -70.51 137.75 50.46 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.128 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.848 -1.072 . . . . 0.0 112.265 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.725 ' HD2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 120.829 0.347 . . . . 0.0 111.487 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.83 156.66 39.05 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.015 0.436 . . . . 0.0 110.065 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.515 HD23 HD11 ' B' ' 5' ' ' ILE . 4.8 tp -159.38 139.23 11.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.157 -178.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -122.8 133.94 54.43 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.218 179.439 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.59 HD13 HG21 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -154.79 -176.8 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.699 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.602 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 70.6 t-105 -92.51 88.2 6.26 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.674 HD13 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -127.33 96.62 4.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.782 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 31.0 p -65.94 179.93 0.82 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.882 0.849 . . . . 0.0 112.806 -177.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -50.62 -54.14 25.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.337 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -49.82 -26.14 3.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.569 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 25.3 p -90.97 -28.85 17.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.461 HD23 HD12 ' A' ' 3' ' ' LEU . 21.1 mt -76.24 -39.35 54.72 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -60.21 -41.03 92.14 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 113.643 -1.617 . . . . 0.0 107.229 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.598 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -53.94 -40.2 66.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.906 178.231 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.688 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 39.2 mt -77.01 29.41 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -99.5 -61.18 1.4 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -74.34 -22.99 58.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.439 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.698 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.9 mtm -85.65 -21.61 28.32 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.84 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.91 -67.5 0.84 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -55.81 -63.04 1.3 Allowed 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.969 0.414 . . . . 0.0 111.558 -179.152 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.22 -33.95 9.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.513 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' B' ' 18' ' ' MET . 13.7 mm-40 -76.22 -28.96 57.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.571 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 102.88 -12.41 56.2 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 121.201 -0.523 . . . . 0.0 113.012 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.84 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -87.86 -174.51 4.76 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -179.341 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.0 p -105.02 167.28 9.81 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.93 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' B' ' 29' ' ' MET . 0.4 OUTLIER -49.8 -37.8 31.7 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.469 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.491 ' HA ' HD12 ' A' ' 5' ' ' ILE . 4.3 m -79.03 -55.88 4.8 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.418 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.9 mt-10 -56.36 -20.12 17.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.732 ' HB2' HD23 ' B' ' 24' ' ' LEU . 1.6 tpt -70.87 -46.68 62.21 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 122.61 1.195 . . . . 0.0 108.68 177.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.636 HG21 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -75.57 -31.55 23.47 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.298 0 CA-C-N 113.047 -1.888 . . . . 0.0 113.254 -177.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.404 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -65.78 -46.47 78.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 122.397 1.094 . . . . 0.0 108.339 176.318 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.404 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.6 t -58.36 -44.69 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-N 112.711 -2.04 . . . . 0.0 111.142 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.594 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -51.08 -32.18 21.41 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.63 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.651 ' CD1' HD21 ' A' ' 15' ' ' LEU . 18.6 mt -79.2 -31.39 43.77 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.857 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -78.8 -16.3 57.32 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.0 m80 -124.99 16.88 8.53 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.507 ' CE1' ' HB2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -69.96 138.93 52.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.119 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.507 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.171 0 CA-C-O 118.83 -0.605 . . . . 0.0 111.902 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -98.57 105.63 17.8 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tp -125.54 139.25 53.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.712 -178.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.991 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 6.5 m -96.0 139.51 32.08 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.605 HD12 HD22 ' A' ' 7' ' ' LEU . 1.1 pp -152.12 174.06 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.125 0.488 . . . . 0.0 112.227 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.59 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 70.8 t-105 -90.34 106.76 18.71 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -176.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.605 HD22 HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -133.15 115.65 15.31 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.446 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.546 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.6 p -89.37 -173.77 4.13 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.494 0.664 . . . . 0.0 111.875 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -49.65 -58.01 6.1 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.025 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -50.86 -27.28 7.09 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.583 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 28.1 p -91.83 -31.23 15.8 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.205 0.816 . . . . 0.0 113.205 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 8' ' ' SER . 46.1 mt -72.17 -40.55 67.88 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.49 -41.2 98.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.079 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.583 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.16 -44.88 61.55 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.404 178.949 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.631 HD21 HD12 ' B' ' 34' ' ' LEU . 22.9 mt -79.41 24.87 0.33 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -104.47 -58.81 1.83 Allowed 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -73.86 -32.03 63.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.425 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.558 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 43.1 mtm -74.09 -61.72 1.75 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.224 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.85 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -51.8 -48.38 63.87 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 . . . . . 0 CA--C 1.512 -0.512 0 CA-C-O 121.031 0.443 . . . . 0.0 111.218 -179.534 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.85 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 111.854 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.3 p -104.03 165.68 10.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.723 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.499 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 6.9 mttm -40.74 -41.39 1.53 Allowed 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.564 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 85.3 p -73.43 -59.3 2.78 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.326 0.108 . . . . 0.0 111.022 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.535 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 1.8 mm-40 -57.21 -22.07 38.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.176 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.716 ' HB2' HD23 ' A' ' 24' ' ' LEU . 3.6 tpt -71.67 -48.43 47.61 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.891 1.329 . . . . 0.0 108.751 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.612 HG23 ' CD1' ' B' ' 5' ' ' ILE . 0.4 OUTLIER -76.32 -31.74 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.266 0 CA-C-N 112.713 -2.039 . . . . 0.0 114.185 -176.588 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.443 ' O ' HD23 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -70.17 -47.29 62.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 122.155 0.979 . . . . 0.0 109.797 178.383 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.535 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -65.02 -39.14 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-N 113.309 -1.768 . . . . 0.0 111.122 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.631 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -42.87 -61.56 1.24 Allowed 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.419 -1.264 . . . . 0.0 112.169 -179.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.705 ' C ' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -75.07 -28.69 60.45 Favored 'General case' 0 N--CA 1.432 -1.37 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.636 -177.019 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.602 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 8.1 mt-30 -58.17 -20.22 39.18 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.333 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -120.41 25.09 10.02 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.2 0.524 . . . . 0.0 109.683 175.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.629 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -91.5 141.21 28.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.153 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.152 0 C-N-CA 123.471 0.708 . . . . 0.0 112.16 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 2.1 mpt_? . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.858 0.361 . . . . 0.0 111.679 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -109.98 109.27 19.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.475 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.4 tp -134.46 144.25 48.0 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.205 -178.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.991 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -96.46 137.1 36.04 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.612 ' CD1' HG23 ' A' ' 30' ' ' ILE . 4.4 pt -137.41 170.84 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.564 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 75.1 t-105 -100.31 106.81 18.47 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -177.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.495 ' CD2' HG13 ' B' ' 5' ' ' ILE . 0.7 OUTLIER -126.85 114.64 18.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.921 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.568 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 14.3 p -83.04 178.11 8.29 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.814 0.816 . . . . 0.0 112.13 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -51.7 -50.73 59.89 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.921 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -45.46 -35.68 3.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.474 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.771 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -104.7 -14.22 15.65 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' B' ' 8' ' ' SER . 94.1 mt -65.07 -39.25 92.97 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.13 -43.93 93.76 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 113.496 -1.684 . . . . 0.0 107.98 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.771 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -52.67 -40.29 62.74 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.545 178.839 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.625 ' CD2' ' HG ' ' A' ' 34' ' ' LEU . 14.6 mt -77.95 28.96 0.17 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -104.16 -61.54 1.43 Allowed 'General case' 0 N--CA 1.461 0.11 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.459 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 16.6 mtpp -71.87 -21.74 61.61 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.345 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.771 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 25.7 mtm -90.22 -24.72 20.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.399 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.681 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -104.16 -64.38 1.11 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.515 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 10.7 mtp-105 -60.16 -65.74 0.63 Allowed 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 120.998 0.428 . . . . 0.0 111.69 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . 0.459 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -50.6 -33.43 22.06 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.421 179.826 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' B' ' 18' ' ' MET . 16.1 mm-40 -84.84 -11.18 56.22 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.174 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.08 -5.67 84.74 Favored Glycine 0 C--N 1.339 0.737 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.856 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.681 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 72.4 mt -75.49 175.58 8.36 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.568 0.699 . . . . 0.0 111.295 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 10.6 p -119.76 174.5 6.39 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.652 -1.158 . . . . 0.0 108.8 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.494 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.0 mttm -51.14 -29.54 13.84 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 111.687 0.254 . . . . 0.0 111.687 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.59 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 34.5 m -82.51 -60.58 2.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.529 0.332 . . . . 0.0 111.496 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.55 ' HB3' ' CD2' ' B' ' 24' ' ' LEU . 2.6 mt-10 -61.03 -9.19 4.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.221 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.771 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.9 tpt -86.58 -46.62 9.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.546 HG23 HD13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -75.22 -32.89 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 CA-C-N 113.042 -1.89 . . . . 0.0 113.282 -178.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.487 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -70.78 -50.37 36.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 122.119 0.961 . . . . 0.0 109.203 177.776 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.487 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -54.79 -40.31 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 CA-C-N 113.212 -1.813 . . . . 0.0 109.844 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.691 ' CB ' ' HB3' ' A' ' 34' ' ' LEU . . . -44.44 -43.69 7.94 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.894 -1.503 . . . . 0.0 111.242 178.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.631 HD12 HD21 ' A' ' 15' ' ' LEU . 9.4 mt -78.54 -29.25 46.29 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.148 -177.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -70.66 -25.43 63.0 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -133.4 21.65 4.0 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.631 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -64.58 140.21 58.84 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 177.778 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.479 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.661 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.543 ' HB3' ' CD2' ' B' ' 12' ' ' LEU . 1.5 ttt-85 . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.35 118.57 25.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.53 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 mm? -131.46 148.92 52.69 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.436 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.982 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -117.04 128.6 55.32 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.436 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.617 ' CD1' ' HB2' ' A' ' 7' ' ' LEU . 2.4 pp -154.92 172.41 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.774 0.321 . . . . 0.0 111.387 -178.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.588 ' O ' ' HB2' ' B' ' 27' ' ' SER . 57.9 t-105 -79.56 78.21 6.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.553 0.692 . . . . 0.0 111.088 -179.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.636 ' HG ' HD21 ' A' ' 12' ' ' LEU . 54.2 tp -115.54 76.14 0.99 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.751 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 24.3 p -76.1 -145.04 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.475 -177.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.13 -155.28 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.245 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.53 44.43 0.11 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.323 0.649 . . . . 0.0 112.299 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.747 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 0.6 OUTLIER -178.5 -50.34 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.432 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.636 HD21 ' HG ' ' A' ' 7' ' ' LEU . 19.1 mt -70.17 -41.09 74.23 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 175.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -79.09 -39.78 32.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.037 -1.892 . . . . 0.0 108.323 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.747 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -50.6 -29.08 10.01 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.796 178.623 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.778 ' CD1' ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -77.38 31.8 0.15 Allowed 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.217 1.007 . . . . 0.0 112.929 179.71 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -76.61 -59.81 2.61 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -96.71 13.13 29.45 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.628 ' HB2' HD13 ' A' ' 15' ' ' LEU . 8.5 mtm -102.08 -76.68 0.57 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.09 0.405 . . . . 0.0 111.271 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.62 ' CB ' HD12 ' A' ' 15' ' ' LEU . . . -26.39 -32.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 126.507 1.923 . . . . 0.0 114.377 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' MET . 31.4 mmm-85 . . . . . 0 C--N 1.307 -1.25 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.344 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.478 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 122.151 0.977 . . . . 0.0 112.953 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -65.09 167.57 7.82 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.171 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -43.05 64.19 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' B' ' 6' ' ' TRP . 23.7 p -83.81 -47.52 11.03 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.892 -0.14 . . . . 0.0 111.086 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.401 ' HB3' ' HB3' ' A' ' 24' ' ' LEU . 2.8 mt-10 -56.04 -30.5 62.0 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.778 ' SD ' ' CD1' ' A' ' 15' ' ' LEU . 4.7 tpt -59.83 -47.83 84.12 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 122.69 1.233 . . . . 0.0 109.952 177.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.618 HG23 ' CD1' ' B' ' 7' ' ' LEU . 0.3 OUTLIER -79.34 -27.09 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.508 0 CA-C-N 112.828 -1.987 . . . . 0.0 114.099 -175.471 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.436 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -70.62 -48.68 53.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 122.286 1.041 . . . . 0.0 108.82 176.664 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.442 ' CG2' HD13 ' A' ' 24' ' ' LEU . 1.7 t -60.17 -46.19 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-N 112.986 -1.916 . . . . 0.0 111.553 -179.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.686 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -45.54 -40.6 8.84 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.236 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.629 HD21 ' HB1' ' B' ' 33' ' ' ALA . 11.4 mt -80.5 -28.8 37.39 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.245 -177.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -71.91 -13.94 61.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.509 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.6 m80 -129.83 46.25 2.68 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.572 0.225 . . . . 0.0 111.153 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.736 ' HA ' ' CD2' ' B' ' 36' ' ' HIS . 0.8 OUTLIER -60.46 132.12 52.89 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.312 0.577 . . . . 0.0 112.025 179.926 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.633 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.9 mmmt . . . . . 0 C--O 1.249 1.066 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.889 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.751 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 121.028 0.442 . . . . 0.0 111.806 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.4 173.6 4.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.191 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.512 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 2.1 tp -173.4 150.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.738 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.982 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.9 OUTLIER -129.47 130.66 46.15 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.463 178.689 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.52 ' CD1' HG21 ' A' ' 30' ' ' ILE . 5.4 pt -144.47 176.66 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.432 ' O ' ' HB2' ' A' ' 27' ' ' SER . 76.4 t-105 -103.05 98.4 8.35 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.618 ' CD1' HG23 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -125.55 126.98 45.68 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 175.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' B' ' 12' ' ' LEU . 2.3 t -81.87 -150.46 0.08 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.141 -0.624 . . . . 0.0 109.496 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -87.56 -163.56 0.96 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . 0.413 ' O ' ' HB ' ' B' ' 11' ' ' THR . 2.2 tt0 35.77 39.14 0.06 Allowed 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.448 0.699 . . . . 0.0 112.309 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.685 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 1.9 t -176.57 -52.36 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.671 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.584 HD13 ' CG ' ' B' ' 13' ' ' GLU . 0.1 OUTLIER -67.93 -33.15 74.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.266 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.584 ' CG ' HD13 ' B' ' 12' ' ' LEU . 29.6 mt-10 -96.41 -37.64 10.37 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.062 -1.426 . . . . 0.0 109.271 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.685 ' HB2' ' N ' ' B' ' 11' ' ' THR . 1.5 m-20 -56.7 -34.54 67.53 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.666 -178.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.774 ' CD2' ' HG2' ' B' ' 29' ' ' MET . 0.0 OUTLIER -71.58 -5.02 30.28 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.512 ' N ' HD21 ' B' ' 15' ' ' LEU . 10.9 mm-40 -60.11 -46.95 87.91 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.334 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -55.56 -35.59 65.9 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.101 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.501 ' CE ' ' HB2' ' B' ' 15' ' ' LEU . 34.8 mtm -69.57 -59.8 2.73 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.105 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.768 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -36.41 -46.88 0.58 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.463 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 1.5 mmm-85 -67.7 -73.73 0.13 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -50.86 -29.99 13.32 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.59 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.451 ' HG3' ' HB3' ' B' ' 18' ' ' MET . 25.0 mm-40 -79.29 -27.65 42.24 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.688 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 94.58 67.17 1.02 Allowed Glycine 0 C--N 1.341 0.83 0 C-N-CA 120.263 -0.97 . . . . 0.0 113.587 178.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.768 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 177.86 -176.74 0.19 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.099 0.476 . . . . 0.0 111.554 178.038 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' SER . . . . . 0.445 ' N ' HD21 ' B' ' 24' ' ' LEU . 3.5 t -115.79 176.4 5.1 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.125 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.501 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.9 mttm -41.44 -39.53 1.53 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.588 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 26.6 p -73.3 -63.77 1.12 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.664 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.8 mm-40 -59.19 -18.6 37.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.79 ' HE2' ' CG2' ' B' ' 32' ' ' VAL . 1.1 tpt -74.55 -48.08 28.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 123.793 1.758 . . . . 0.0 107.494 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.501 ' HB ' ' O ' ' B' ' 26' ' ' LYS . 0.5 OUTLIER -65.79 -23.26 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.82 0 CA-C-N 112.79 -2.005 . . . . 0.0 112.062 -178.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -85.17 -44.74 12.68 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.741 176.779 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.79 ' CG2' ' HE2' ' B' ' 29' ' ' MET . 4.4 m -52.39 -34.59 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-O 121.969 0.89 . . . . 0.0 109.211 178.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.884 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -37.72 -45.33 0.79 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.065 -1.879 . . . . 0.0 111.734 178.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.651 HD13 HD21 ' A' ' 15' ' ' LEU . 8.5 mt -83.01 -32.29 27.0 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.638 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -21.18 60.18 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.884 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 8.0 p-80 -105.71 -27.84 11.07 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.686 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 12.5 t80 -52.06 149.21 5.33 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.003 0.365 . . . . 0.0 110.067 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.564 ' HD3' ' CE2' ' B' ' 37' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 123.342 0.657 . . . . 0.0 112.455 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.794 ' HD2' HD22 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.727 0.299 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -70.91 128.5 36.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 110.301 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.481 HD22 HD11 ' A' ' 5' ' ' ILE . 2.3 tp -123.93 135.75 53.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.609 -178.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 1.01 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -131.84 123.55 27.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.156 179.33 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.65 HD11 HG21 ' B' ' 30' ' ' ILE . 0.1 OUTLIER -152.64 -173.79 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.096 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -91.82 92.21 8.28 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -177.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.609 ' CD1' HG23 ' B' ' 30' ' ' ILE . 2.0 mm? -129.56 103.37 6.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.606 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 28.4 p -66.3 -142.71 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 120.87 0.367 . . . . 0.0 111.515 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -97.46 -147.4 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.065 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.502 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.8 tt0 32.42 45.75 0.06 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.483 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.808 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.6 OUTLIER -172.53 -51.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.694 179.166 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.572 HD23 HD21 ' B' ' 3' ' ' LEU . 17.1 mt -72.19 -41.47 66.92 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -81.15 -38.79 26.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.59 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.808 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -42.83 -28.52 0.25 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-N 114.538 -1.21 . . . . 0.0 111.081 179.209 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.784 ' HG ' ' HG2' ' A' ' 29' ' ' MET . 0.1 OUTLIER -65.24 9.0 0.12 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -53.56 -41.03 66.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -87.26 -24.63 24.3 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.689 ' HB2' ' CD1' ' A' ' 15' ' ' LEU . 4.1 mtm -97.75 -65.85 0.94 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.711 ' HB1' ' HB3' ' A' ' 15' ' ' LEU . . . -33.9 -31.38 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 . . . . . 0 C--N 1.31 -1.136 0 C-N-CA 119.524 -0.87 . . . . 0.0 110.743 179.453 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.626 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 122.11 0.957 . . . . 0.0 113.192 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.457 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.1 p -62.51 159.34 15.91 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.341 -1.3 . . . . 0.0 109.468 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.46 -42.31 6.97 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.505 ' HA ' HD13 ' B' ' 5' ' ' ILE . 28.7 p -80.88 -40.97 23.87 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.626 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mm-40 -61.82 -28.39 69.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.125 -0.23 . . . . 0.0 110.757 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.784 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -67.11 -42.38 84.62 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-O 122.512 1.148 . . . . 0.0 108.567 177.586 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.651 HG21 ' CD1' ' B' ' 7' ' ' LEU . 0.3 OUTLIER -76.77 -35.04 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.365 0 CA-C-N 112.725 -2.034 . . . . 0.0 113.473 -175.474 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.461 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -63.97 -46.85 82.83 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.517 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -58.7 -41.27 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 CA-C-N 112.635 -2.075 . . . . 0.0 111.425 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.771 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -45.42 -41.16 8.95 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.696 -1.138 . . . . 0.0 112.119 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.657 HD11 ' CD1' ' B' ' 15' ' ' LEU . 7.0 mt -81.47 -29.87 33.57 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.961 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -71.67 -17.51 62.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 33.2 m80 -118.23 39.61 3.38 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.596 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 58.1 t80 -90.01 162.81 15.19 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.374 -178.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.557 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.271 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.606 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.978 0.418 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -75.82 138.45 41.16 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.963 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.572 HD21 HD23 ' A' ' 12' ' ' LEU . 2.2 tp -128.33 133.13 48.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.469 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 1.01 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -126.19 123.78 38.99 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.776 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.538 HG13 ' CD2' ' B' ' 7' ' ' LEU . 1.6 pt -154.29 175.69 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.437 ' O ' HD11 ' B' ' 7' ' ' LEU . 75.3 t-105 -88.57 96.13 10.51 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.651 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.1 mm? -119.5 118.93 32.39 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.578 ' C ' HD23 ' B' ' 12' ' ' LEU . 44.9 p -65.7 164.97 13.41 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.995 0.903 . . . . 0.0 111.165 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.658 ' HA ' HD23 ' B' ' 12' ' ' LEU . 8.3 t70 -64.45 -37.9 89.16 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 113.633 -1.621 . . . . 0.0 112.924 -177.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -73.16 38.75 0.09 Allowed 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.78 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 7.9 t -174.17 -51.54 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.975 0.51 . . . . 0.0 111.877 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.794 HD22 ' HD2' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -57.54 -28.61 63.68 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 176.674 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 68.7 mm-40 -84.23 -38.9 19.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.393 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.78 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.2 t70 -44.14 -29.58 0.64 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.829 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.802 HD12 HG12 ' B' ' 30' ' ' ILE . 28.9 mt -79.4 27.07 0.27 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.1 OUTLIER -111.46 -52.18 2.8 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.247 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -76.93 -32.68 57.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 120.835 0.35 . . . . 0.0 110.597 178.812 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.449 ' HE2' ' CG ' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -97.25 20.64 11.14 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.111 179.32 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.849 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -100.03 -19.79 16.36 Favored 'General case' 0 C--O 1.214 -0.779 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 39.1 mmm-85 -65.67 -126.35 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.726 0 O-C-N 121.657 -0.652 . . . . 0.0 110.468 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -52.69 -22.85 5.64 Favored 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 121.681 -0.637 . . . . 0.0 110.439 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -93.64 -23.43 18.27 Favored 'General case' 0 CA--C 1.522 -0.127 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . 0.849 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -134.99 16.28 4.22 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 117.19 -2.433 . . . . 0.0 116.369 -177.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' B' ' 19' ' ' ALA . 1.0 OUTLIER 55.56 -166.18 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.653 1.226 . . . . 0.0 113.667 175.846 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.1 m -53.94 149.56 8.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.145 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -41.8 -46.44 3.9 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.427 ' HA ' HD13 ' A' ' 5' ' ' ILE . 74.5 p -75.87 -44.13 42.19 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.652 0.263 . . . . 0.0 110.702 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.541 ' O ' HG23 ' B' ' 32' ' ' VAL . 3.6 mt-10 -54.78 -38.68 67.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.74 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.75 ' HE1' ' CG2' ' B' ' 32' ' ' VAL . 4.0 tpt -57.89 -47.21 83.45 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 123.623 1.678 . . . . 0.0 108.935 177.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.802 HG12 HD12 ' B' ' 15' ' ' LEU . 0.3 OUTLIER -65.9 -21.45 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.667 0 CA-C-N 112.972 -1.922 . . . . 0.0 112.649 -178.099 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.404 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -83.53 -46.36 12.52 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 177.49 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.75 ' CG2' ' HE1' ' B' ' 29' ' ' MET . 0.0 OUTLIER -58.66 -30.3 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.062 0 CA-C-O 121.878 0.847 . . . . 0.0 109.009 177.833 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.975 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.15 -54.71 1.73 Allowed 'General case' 0 CA--C 1.495 -1.14 0 CA-C-N 113.599 -1.637 . . . . 0.0 108.729 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.612 ' CD1' ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -67.44 -46.72 72.26 Favored 'General case' 0 N--CA 1.399 -2.976 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.243 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . 0.612 ' N ' ' CD1' ' B' ' 34' ' ' LEU . 4.6 mt-30 -64.21 -59.33 4.55 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.975 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.3 p80 -65.87 -16.41 63.81 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.771 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.8 OUTLIER -55.83 137.69 49.62 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.577 0.351 . . . . 0.0 110.298 178.682 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.48 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.067 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.775 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.775 0.322 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.471 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.5 m95 -78.95 165.76 23.12 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.427 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 tp -171.34 147.29 2.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.238 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.99 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -108.57 140.32 42.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.658 ' CD1' HG22 ' B' ' 30' ' ' ILE . 3.8 pt -147.92 176.64 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.687 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 76.6 t-105 -100.86 100.77 11.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.498 ' O ' ' HB2' ' B' ' 1' ' ' ARG . 0.7 OUTLIER -131.18 114.62 15.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.712 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -88.54 -167.11 1.78 Allowed 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.422 0.63 . . . . 0.0 112.303 -178.209 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -50.85 -57.99 7.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.784 -1.098 . . . . 0.0 112.419 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.25 -29.55 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.587 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 69.8 p -95.26 -33.39 12.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 8' ' ' SER . 69.9 mt -67.94 -40.69 83.23 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 178.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -59.98 -43.91 94.81 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.749 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.587 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -57.06 -51.62 68.53 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.395 -1.275 . . . . 0.0 109.564 178.236 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.619 ' CD1' HG12 ' A' ' 30' ' ' ILE . 14.8 mt -78.15 24.56 0.25 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.87 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.419 ' CG ' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -114.99 -52.96 2.67 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 178.454 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.419 ' N ' ' CG ' ' A' ' 16' ' ' GLU . 0.8 OUTLIER -87.49 -32.82 19.25 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 122.667 0.387 . . . . 0.0 110.782 178.522 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.6 ' CE ' ' HB2' ' B' ' 34' ' ' LEU . 0.5 OUTLIER -91.73 6.04 47.49 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.46 179.619 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -97.21 -15.53 20.81 Favored 'General case' 0 C--O 1.211 -0.928 0 C-N-CA 122.669 0.388 . . . . 0.0 111.737 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.404 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.785 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.694 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 122.341 1.067 . . . . 0.0 113.54 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.479 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.8 p -60.48 156.78 15.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.666 178.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.55 -40.15 2.56 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.3 m -79.68 -49.36 12.21 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.247 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.694 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 3.2 mm-40 -55.49 -30.41 60.57 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.387 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.597 ' O ' ' CE ' ' A' ' 29' ' ' MET . 3.6 tpt -61.01 -50.84 71.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.069 1.414 . . . . 0.0 108.767 177.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.619 HG12 ' CD1' ' A' ' 15' ' ' LEU . 0.4 OUTLIER -71.81 -34.66 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.523 0 CA-C-N 112.929 -1.941 . . . . 0.0 114.133 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.25 -47.98 72.0 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.872 0.844 . . . . 0.0 109.092 177.284 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.671 HG23 HD13 ' A' ' 24' ' ' LEU . 0.9 OUTLIER -59.12 -39.43 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-N 113.684 -1.598 . . . . 0.0 111.445 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.692 ' HB1' ' HB3' ' B' ' 34' ' ' LEU . . . -47.56 -40.37 18.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.063 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.513 HD13 ' CD2' ' B' ' 15' ' ' LEU . 11.9 mt -78.51 -28.47 46.25 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.364 -177.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.23 -18.83 57.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.413 ' HD1' HG11 ' A' ' 32' ' ' VAL . 57.6 m80 -104.75 -38.79 6.56 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.585 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 24.6 t80 -44.32 153.6 0.15 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.954 0.407 . . . . 0.0 111.966 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.522 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 9.3 mmmt . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.493 -0.765 . . . . 0.0 111.364 177.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.712 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.2 mpt_? . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.194 0.521 . . . . 0.0 111.861 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 74.4 m95 -114.66 105.04 12.59 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.5 tp -126.49 146.57 50.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.819 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.99 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -106.01 136.73 45.15 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.921 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.602 ' CD1' HG23 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -148.41 -177.57 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.403 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -92.28 90.13 7.14 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.599 HD12 ' CG2' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -127.01 94.41 4.02 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.775 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 42.6 p -64.58 177.54 0.89 Allowed 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.79 0.805 . . . . 0.0 112.342 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -52.87 -50.07 64.54 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.196 -1.365 . . . . 0.0 111.67 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.0 -26.55 6.18 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.624 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 26.1 p -92.45 -25.65 18.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' B' ' 8' ' ' SER . 22.7 mt -77.88 -40.71 39.12 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.72 -40.95 89.7 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 113.957 -1.474 . . . . 0.0 107.233 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.542 ' O ' ' HG3' ' B' ' 18' ' ' MET . 41.8 t0 -54.82 -39.22 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 114.016 -1.447 . . . . 0.0 110.276 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.709 HD22 ' SD ' ' B' ' 29' ' ' MET . 32.1 mt -76.96 27.72 0.14 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 47.4 mt-10 -99.82 -54.46 2.9 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -77.48 -22.0 51.97 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.51 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.859 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 11.3 mtm -91.29 -24.21 19.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.944 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.686 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.32 -66.51 0.91 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -54.7 -67.82 0.24 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -179.419 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -31.44 11.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.405 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.508 ' HB2' ' O ' ' B' ' 18' ' ' MET . 15.9 mm-40 -87.95 -9.94 52.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.261 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.26 -3.39 86.25 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.855 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.686 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 87.3 mt -75.74 172.65 12.28 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.532 0.682 . . . . 0.0 111.6 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.4 p -115.47 163.4 15.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 mttm -42.16 -41.56 2.71 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.687 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 4.3 m -84.77 -50.5 7.53 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.611 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.5 mt-10 -64.49 -7.98 12.07 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.732 0.301 . . . . 0.0 110.245 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.859 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.0 tpt -85.37 -47.15 10.27 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 122.639 1.209 . . . . 0.0 108.028 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.658 HG22 ' CD1' ' A' ' 5' ' ' ILE . 0.4 OUTLIER -75.86 -40.96 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 112.971 -1.922 . . . . 0.0 113.141 -177.436 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -44.76 95.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.972 0.891 . . . . 0.0 109.658 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.611 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -70.49 -32.86 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 113.714 -1.585 . . . . 0.0 112.545 -179.208 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.585 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -54.7 -53.14 58.87 Favored 'General case' 0 CA--C 1.501 -0.916 0 CA-C-O 121.889 0.852 . . . . 0.0 110.163 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.692 ' HB3' ' HB1' ' A' ' 33' ' ' ALA . 4.0 pp -72.27 -25.52 61.63 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.744 -1.571 . . . . 0.0 112.033 -178.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -19.75 65.78 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 55.0 m80 -116.27 24.37 11.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 175.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -95.87 143.96 26.63 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.323 0.649 . . . . 0.0 110.124 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.441 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.724 -0.655 . . . . 0.0 112.225 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.719 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.071 0.462 . . . . 0.0 111.881 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -112.3 111.04 21.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.263 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -127.3 144.08 51.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.362 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.984 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -109.9 136.65 48.86 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.434 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.577 HG13 HD21 ' A' ' 7' ' ' LEU . 1.8 pt -150.08 176.82 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -93.61 90.91 6.82 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -177.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.577 HD21 HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -124.64 104.14 8.52 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.519 ' HA ' ' HB2' ' B' ' 1' ' ' ARG . 6.9 t -78.77 -139.1 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -80.59 -160.09 0.28 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.258 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.415 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.9 tt0 35.07 45.07 0.16 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-O 121.538 0.685 . . . . 0.0 111.667 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.774 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.65 -52.33 0.02 OUTLIER 'General case' 0 C--O 1.23 0.079 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.893 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 8' ' ' SER . 18.1 mt -73.93 -42.09 61.11 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -76.44 -39.37 53.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 113.125 -1.852 . . . . 0.0 108.207 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.774 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -45.16 -38.69 5.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.302 178.896 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.765 HD23 HD21 ' B' ' 34' ' ' LEU . 3.0 mm? -68.68 7.01 0.72 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.51 ' HG3' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -62.42 -39.81 94.51 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.51 ' N ' ' HG3' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -102.09 -10.85 19.32 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.62 ' HB2' HD13 ' A' ' 15' ' ' LEU . 29.4 mtm -97.91 -66.11 0.92 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.681 ' HB3' HD11 ' A' ' 15' ' ' LEU . . . -36.87 -29.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.477 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 20.8 mmm-85 . . . . . 0 C--N 1.312 -1.058 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.437 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.486 ' N ' ' O ' ' A' ' 19' ' ' ALA . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 122.029 0.919 . . . . 0.0 112.739 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -61.14 160.27 10.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.269 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.22 -39.29 13.79 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.621 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 69.5 m -79.04 -44.55 21.96 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.72 0.266 . . . . 0.0 111.72 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.466 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 9.8 mm-40 -61.72 -31.31 71.47 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.907 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.745 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.26 -38.8 92.34 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.771 1.272 . . . . 0.0 107.77 177.029 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.68 HG22 HD13 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -76.18 -17.98 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.97 0 CA-C-N 112.744 -2.025 . . . . 0.0 113.569 -176.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.532 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -73.18 -51.97 15.86 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.115 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.532 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 7.3 p -65.95 -28.46 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.441 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.763 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -41.97 -42.44 2.81 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.811 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.604 HD12 HD22 ' B' ' 15' ' ' LEU . 9.0 mt -84.49 -27.7 27.25 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.157 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.401 ' HB2' ' HA ' ' A' ' 32' ' ' VAL . 31.2 mt-30 -63.53 -32.58 74.08 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.763 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 14.0 p-80 -97.91 -38.11 9.54 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.339 0.518 . . . . 0.0 112.178 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.564 ' CG ' ' HA ' ' B' ' 33' ' ' ALA . 21.4 t80 -45.87 141.18 3.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.427 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.129 0 C-N-CA 123.678 0.791 . . . . 0.0 112.269 178.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.519 ' HB2' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 120.725 0.298 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -100.28 114.16 27.42 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 tp -133.07 145.4 50.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.643 -178.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.984 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -111.6 136.34 50.94 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.68 HD13 HG22 ' A' ' 30' ' ' ILE . 1.5 pt -147.04 -176.89 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.621 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 71.0 t-105 -98.69 98.49 9.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.53 HD12 ' CG2' ' A' ' 30' ' ' ILE . 0.8 OUTLIER -131.14 108.8 9.99 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.575 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.719 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -92.52 -164.96 1.25 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.436 0.636 . . . . 0.0 112.053 -178.225 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -45.15 -62.57 1.2 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.513 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -50.79 -29.75 12.39 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.547 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 68.6 p -88.46 -34.74 17.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' B' ' 8' ' ' SER . 45.0 mt -69.95 -40.01 75.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -61.95 -41.92 98.53 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.783 -1.553 . . . . 0.0 107.736 175.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.547 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.4 OUTLIER -53.35 -49.43 67.15 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.003 178.516 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.73 HD23 ' CG ' ' B' ' 29' ' ' MET . 17.9 mt -73.76 8.38 1.97 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.74 -40.1 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.72 -26.59 29.62 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.796 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.0 mtm -86.23 -64.43 1.15 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.752 -0.204 . . . . 0.0 111.4 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.633 ' HB3' ' HB2' ' B' ' 29' ' ' MET . . . -47.89 -43.94 29.12 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.683 0.393 . . . . 0.0 111.871 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.443 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 24.0 mmm-85 -61.01 -68.76 0.28 Allowed 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 111.597 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -31.64 37.25 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.95 179.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.457 ' HB3' ' HG ' ' B' ' 24' ' ' LEU . 20.7 mm-40 -86.51 -10.47 54.04 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.289 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.15 14.22 68.21 Favored Glycine 0 C--N 1.341 0.809 0 C-N-CA 120.499 -0.858 . . . . 0.0 111.582 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.576 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 90.5 mt -86.8 166.77 14.97 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.56 0.695 . . . . 0.0 111.844 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 83.7 p -103.44 164.34 11.71 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.355 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -43.54 -35.98 1.89 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -179.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.482 ' HA ' HD11 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -85.59 -56.63 3.41 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.254 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.1 mt-10 -58.89 -15.34 12.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.612 0.244 . . . . 0.0 110.386 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.796 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.7 tpt -79.29 -48.1 14.72 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 122.6 1.19 . . . . 0.0 108.227 177.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.508 HG12 ' CD1' ' B' ' 15' ' ' LEU . 0.4 OUTLIER -75.58 -33.89 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.037 0 CA-C-N 113.191 -1.822 . . . . 0.0 113.436 -177.36 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.544 ' O ' HD13 ' B' ' 34' ' ' LEU . 0.0 OUTLIER -67.65 -45.93 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.798 0.809 . . . . 0.0 109.933 178.291 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.547 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.0 OUTLIER -66.77 -37.43 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 114.277 -1.329 . . . . 0.0 112.192 -178.916 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.564 ' HA ' ' CG ' ' A' ' 37' ' ' TYR . . . -61.26 -47.54 85.55 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 122.031 0.92 . . . . 0.0 109.662 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.765 HD21 HD23 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -68.98 -42.8 76.07 Favored 'General case' 0 N--CA 1.401 -2.881 0 CA-C-N 113.34 -1.755 . . . . 0.0 111.121 -177.908 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . 0.582 ' N ' ' CD1' ' B' ' 34' ' ' LEU . 4.6 mt-30 -64.3 -19.32 65.34 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -94.29 27.29 2.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.179 0.514 . . . . 0.0 109.647 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.688 ' CD1' ' CE1' ' A' ' 36' ' ' HIS . 7.9 t80 -103.16 156.02 18.0 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.494 -178.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.426 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.06 0 C-N-CA 124.449 1.1 . . . . 0.0 112.334 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.607 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 3.6 ttt85 . . . . . 0 N--CA 1.486 1.353 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -78.26 124.79 28.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.501 HD23 HD22 ' B' ' 12' ' ' LEU . 2.0 tp -138.61 141.03 39.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.308 -178.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.998 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -106.3 136.53 45.86 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 178.286 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.681 ' CD1' HG23 ' B' ' 30' ' ' ILE . 4.9 pt -146.95 175.5 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 27' ' ' SER . 75.0 t-105 -98.78 109.17 21.97 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -177.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.51 ' CD1' ' CG2' ' B' ' 30' ' ' ILE . 0.9 OUTLIER -131.26 117.18 18.63 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.536 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 14.9 p -82.86 178.02 8.37 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 121.783 0.802 . . . . 0.0 111.969 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -53.88 -50.43 66.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.962 -1.472 . . . . 0.0 111.788 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.3 -35.9 3.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.229 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.798 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -101.01 -15.97 17.29 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 8' ' ' SER . 78.8 mt -69.58 -38.96 77.57 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 105.474 -2.047 . . . . 0.0 105.474 175.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -61.16 -41.09 96.14 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 113.226 -1.806 . . . . 0.0 107.502 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.798 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -53.58 -48.42 69.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.028 178.075 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.701 HD13 HG12 ' A' ' 30' ' ' ILE . 19.2 mt -80.41 16.07 1.43 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.478 -0.783 . . . . 0.0 113.099 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.519 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -100.41 -44.69 5.82 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.632 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.519 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 7.2 mttm -88.75 -38.74 14.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.703 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.494 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 46.8 mtm -66.28 -70.6 0.23 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.497 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 15' ' ' LEU . . . -27.7 -32.1 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 125.081 1.352 . . . . 0.0 114.161 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.469 ' N ' ' O ' ' A' ' 18' ' ' MET . 1.5 mtt-85 . . . . . 0 C--N 1.309 -1.173 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.08 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.585 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 122.15 0.976 . . . . 0.0 113.0 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.454 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 14.8 p -66.22 158.92 27.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.635 -1.166 . . . . 0.0 109.852 178.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.52 -38.73 4.35 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.9 m -79.51 -52.65 7.75 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 122.089 0.156 . . . . 0.0 111.072 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.585 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -57.26 -27.39 62.05 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.26 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.539 ' O ' ' CE ' ' A' ' 29' ' ' MET . 3.3 tpt -64.53 -47.83 77.38 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 122.973 1.368 . . . . 0.0 108.824 177.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.701 HG12 HD13 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -75.57 -27.83 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.499 0 CA-C-N 112.671 -2.059 . . . . 0.0 114.268 -176.389 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.482 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -73.36 -52.01 15.35 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.812 0.815 . . . . 0.0 109.277 177.039 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -55.22 -40.18 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-N 113.75 -1.568 . . . . 0.0 111.077 -179.516 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.669 ' CB ' HD21 ' B' ' 34' ' ' LEU . . . -50.34 -40.42 49.11 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.61 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.617 HD22 HG12 ' B' ' 30' ' ' ILE . 12.1 mt -74.92 -35.49 62.19 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.256 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -74.41 -11.1 60.15 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.5 m80 -106.61 -46.86 3.89 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 117.089 -0.05 . . . . 0.0 110.967 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.718 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 12.0 t80 -41.65 147.68 0.18 Allowed 'General case' 0 CA--C 1.541 0.607 0 O-C-N 123.275 0.359 . . . . 0.0 111.836 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.523 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 6.0 tppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.171 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -95.33 105.81 17.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -121.45 142.87 49.61 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.957 -178.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.998 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -108.29 137.47 46.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 177.836 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.587 HD11 HD22 ' B' ' 7' ' ' LEU . 2.4 pp -151.59 167.88 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 121.179 0.514 . . . . 0.0 112.374 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -83.63 94.48 8.11 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.925 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.588 HD11 HG21 ' A' ' 30' ' ' ILE . 0.9 OUTLIER -129.29 99.89 5.39 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.216 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.607 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 52.3 p -72.66 -135.86 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.353 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.19 -151.7 0.27 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.891 -0.141 . . . . 0.0 111.295 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 33.92 43.62 0.07 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.502 0.721 . . . . 0.0 112.634 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.679 ' CA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -173.24 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.705 179.189 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.541 ' N ' HG22 ' B' ' 11' ' ' THR . 22.8 mt -76.55 -42.0 44.57 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.44 -41.21 40.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.483 -1.689 . . . . 0.0 108.293 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.679 ' HB2' ' CA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.28 -17.37 1.74 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.424 179.008 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.743 ' CD1' ' HB2' ' B' ' 18' ' ' MET . 0.2 OUTLIER -71.59 21.04 0.05 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -179.683 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.17 -56.8 12.2 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 122.251 -0.281 . . . . 0.0 111.155 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.619 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 4.6 mtpm? -91.83 -2.05 57.06 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.743 ' HB2' ' CD1' ' B' ' 15' ' ' LEU . 3.9 mtm -96.99 -32.79 11.83 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.841 ' HA ' HD22 ' B' ' 24' ' ' LEU . . . -99.33 -73.3 0.63 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.468 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 0.2 OUTLIER -55.97 -62.41 1.72 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.556 0.694 . . . . 0.0 111.47 -179.371 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . 0.619 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.01 -28.0 3.63 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.708 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.771 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -87.97 -30.72 19.82 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.014 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.97 -7.48 31.22 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.886 -0.673 . . . . 0.0 114.519 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.853 ' C ' HD21 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -93.9 -174.02 3.31 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.096 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 96.4 p -103.97 164.2 11.86 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.099 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.1 OUTLIER -45.58 -40.47 8.84 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.279 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.58 ' HB2' ' HB3' ' A' ' 6' ' ' TRP . 59.8 p -81.43 -50.5 9.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.416 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.7 mm-40 -59.29 -20.1 51.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.72 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.673 ' C ' ' SD ' ' B' ' 29' ' ' MET . 0.0 OUTLIER -72.22 -39.85 68.23 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 122.629 1.204 . . . . 0.0 108.63 177.469 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.681 HG23 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -77.88 -38.09 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.482 0 CA-C-N 112.636 -2.074 . . . . 0.0 113.262 -175.494 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.427 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -60.8 -44.56 96.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 122.671 1.224 . . . . 0.0 107.815 175.755 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.427 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -59.97 -44.94 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 CA-C-N 112.271 -2.24 . . . . 0.0 111.872 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.718 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -51.8 -33.63 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.294 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.669 HD21 ' CB ' ' A' ' 33' ' ' ALA . 15.6 mt -76.4 -32.96 58.84 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.442 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -79.41 -16.72 55.71 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -123.73 21.18 9.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.17 0.441 . . . . 0.0 111.324 176.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.57 131.57 37.91 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.793 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.452 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.722 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.814 ' HD3' HD23 ' B' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.167 0.508 . . . . 0.0 112.104 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -92.02 120.58 32.79 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.55 ' HB3' HD22 ' B' ' 7' ' ' LEU . 2.8 tp -117.45 142.26 47.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -130.53 125.61 34.72 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.93 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' B' ' 27' ' ' SER . 2.1 pt -152.02 -178.92 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.5 t-105 -94.72 98.38 10.74 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -177.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.686 HD11 HG21 ' B' ' 30' ' ' ILE . 1.5 mm? -125.09 111.34 15.23 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 29.5 t -76.8 -125.07 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.577 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 8.9 t70 -95.9 -45.47 6.93 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -68.43 45.41 0.04 OUTLIER 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.187 0.595 . . . . 0.0 112.005 -178.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.782 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.5 t -170.62 -42.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.426 ' N ' HG23 ' A' ' 11' ' ' THR . 31.4 mt -72.66 -39.82 66.81 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.577 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 0.2 OUTLIER -68.7 -39.58 80.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 113.511 -1.677 . . . . 0.0 107.033 176.01 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.782 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -48.3 -37.93 17.64 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.097 -1.411 . . . . 0.0 109.203 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.679 HD13 HG12 ' A' ' 30' ' ' ILE . 42.4 mt -84.86 33.39 0.53 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.811 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -107.55 -58.03 2.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.03 -33.47 61.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.734 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.471 ' HG2' ' HG3' ' B' ' 38' ' ' LYS . 33.4 mtm -74.84 -67.42 0.64 Allowed 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.019 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.5 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -28.87 -31.57 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.857 1.263 . . . . 0.0 114.121 -178.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' A' ' 18' ' ' MET . 3.7 mtt-85 . . . . . 0 C--N 1.31 -1.151 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.086 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.515 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.163 0 CA-C-O 122.226 1.013 . . . . 0.0 113.38 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -59.89 166.73 2.52 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.97 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.419 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -57.63 -42.68 83.87 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.98 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 94.2 p -74.24 -46.11 43.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.711 0.291 . . . . 0.0 110.273 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.515 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.5 mt-10 -61.08 -35.23 76.43 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.777 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.677 ' HE2' ' CG2' ' A' ' 32' ' ' VAL . 3.3 tpt -62.4 -47.95 81.88 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 123.64 1.686 . . . . 0.0 108.687 177.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.736 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -67.86 -15.68 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.979 0 CA-C-N 112.876 -1.965 . . . . 0.0 112.876 -177.572 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -83.3 -46.49 12.56 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.002 176.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.767 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -60.59 -34.86 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.978 0 CA-C-O 121.596 0.712 . . . . 0.0 109.217 177.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.918 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.28 -46.76 0.55 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.814 -1.539 . . . . 0.0 111.057 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.599 HD11 HD23 ' B' ' 15' ' ' LEU . 6.3 mt -87.26 -29.72 21.45 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.184 -178.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -83.64 -15.65 48.14 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.918 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -114.64 -4.46 12.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 -179.499 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.661 ' CD2' ' HD3' ' A' ' 38' ' ' LYS . 4.4 t80 -69.03 157.42 36.83 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.661 ' HD3' ' CD2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.181 0 C-N-CA 124.752 1.221 . . . . 0.0 112.899 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.375 0.131 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -81.43 121.52 26.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.5 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.68 140.55 50.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.469 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.84 129.86 56.34 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.736 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.4 pp -156.6 174.41 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.8 t-105 -91.76 116.11 28.62 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.586 ' O ' HD22 ' B' ' 12' ' ' LEU . 0.6 OUTLIER -129.03 127.91 42.56 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 177.184 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 7.9 p -82.13 -178.33 6.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 121.831 0.825 . . . . 0.0 111.1 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.57 ' HA ' HD21 ' B' ' 12' ' ' LEU . 11.2 t70 -58.36 -44.99 89.06 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.309 -1.314 . . . . 0.0 113.172 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -75.68 40.53 0.19 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.089 0.471 . . . . 0.0 111.939 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.701 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 10.7 t -173.6 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.671 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.814 HD23 ' HD3' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -61.18 -30.12 70.21 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.048 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.501 ' HG2' ' HG ' ' B' ' 12' ' ' LEU . 2.5 mm-40 -99.52 -36.07 9.67 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.974 -1.466 . . . . 0.0 109.584 177.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.701 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -42.91 -33.41 0.78 Allowed 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.881 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.73 HD13 HG12 ' B' ' 30' ' ' ILE . 49.1 mt -66.74 12.38 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -75.22 -52.47 10.83 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -93.76 -10.15 35.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.692 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.61 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 11.6 mtp -87.11 -21.28 26.11 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.682 0.277 . . . . 0.0 110.966 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.801 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.35 -67.93 0.82 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.826 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.8 mmm180 -58.93 -70.28 0.16 Allowed 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.57 -33.6 6.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.796 -179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.61 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 3.8 mm-40 -82.2 -25.41 34.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.291 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . 0.468 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 98.6 64.38 0.86 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.439 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.801 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 179.21 178.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.209 0.528 . . . . 0.0 111.634 177.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' SER . . . . . 0.474 ' N ' HD22 ' B' ' 24' ' ' LEU . 0.8 OUTLIER -105.2 169.08 8.65 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.71 -178.521 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.89 -41.3 11.17 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.543 ' HA ' HD12 ' A' ' 5' ' ' ILE . 1.7 p -78.09 -50.65 11.62 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.445 0.164 . . . . 0.0 110.986 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.564 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.1 mm-40 -65.52 -10.6 36.23 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.412 178.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.649 ' HB2' HD21 ' B' ' 24' ' ' LEU . 2.9 tpt -84.34 -48.45 9.69 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 122.689 1.233 . . . . 0.0 107.788 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.73 HG12 HD13 ' B' ' 15' ' ' LEU . 0.6 OUTLIER -74.13 -34.91 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.95 0 CA-C-N 113.017 -1.901 . . . . 0.0 112.952 -177.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.436 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -65.91 -48.24 72.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 122.384 1.088 . . . . 0.0 109.032 177.386 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -58.73 -43.79 88.6 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.174 0 CA-C-N 112.865 -1.97 . . . . 0.0 111.671 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.617 ' HB1' ' HB2' ' A' ' 33' ' ' ALA . . . -47.32 -31.34 3.81 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.005 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.589 HD22 ' HB1' ' A' ' 33' ' ' ALA . 14.2 mt -91.86 -31.76 15.58 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -72.07 -15.03 62.01 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -111.23 19.81 17.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.114 0.415 . . . . 0.0 111.397 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.495 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 58.6 t80 -114.75 165.61 12.63 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.962 0.41 . . . . 0.0 111.823 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.484 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.162 0 C-N-CA 123.869 0.868 . . . . 0.0 112.603 178.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.537 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.696 0.284 . . . . 0.0 111.695 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.41 126.6 31.06 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -125.35 137.7 54.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.684 -178.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -115.98 121.51 42.49 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.231 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.601 HG13 ' CD2' ' A' ' 7' ' ' LEU . 4.1 pt -145.86 176.3 1.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -177.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -94.02 100.83 12.89 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -177.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.601 ' CD2' HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -128.78 111.47 13.15 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 177.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.558 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 10.0 p -82.37 -176.79 6.39 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 121.724 0.774 . . . . 0.0 112.487 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -50.56 -47.78 57.72 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.474 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -47.03 -31.2 3.11 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.828 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -109.97 -15.29 14.09 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.5 mt -73.83 -41.04 62.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 105.901 -1.888 . . . . 0.0 105.901 176.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.41 -39.12 93.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.333 -1.758 . . . . 0.0 107.996 175.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.828 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -52.08 -44.68 64.47 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.558 178.78 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.628 HD11 HD11 ' B' ' 34' ' ' LEU . 19.6 mt -76.82 13.7 0.98 Allowed 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.3 mm-40 -98.9 -51.61 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 19.1 mttp -73.73 -26.1 60.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.211 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.642 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 58.8 mtm -81.71 -74.75 0.32 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.933 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.678 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.94 -43.42 3.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 122.908 0.483 . . . . 0.0 112.1 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.439 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.1 mmm180 . . . . . 0 CA--C 1.514 -0.414 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.678 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 94.9 mt . . . . . 0 N--CA 1.451 -0.423 0 CA-C-O 121.523 0.678 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.6 p -108.71 164.61 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.973 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.439 ' HB3' HG22 ' B' ' 5' ' ' ILE . 2.4 mttm -46.24 -31.97 2.78 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.571 ' HA ' HD11 ' B' ' 5' ' ' ILE . 1.1 m -84.29 -59.23 2.45 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 122.178 0.191 . . . . 0.0 111.139 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.458 ' HB3' HD21 ' A' ' 24' ' ' LEU . 2.8 mm-40 -59.72 -12.64 7.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.159 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.642 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 3.0 tpt -82.29 -47.17 12.71 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.855 1.312 . . . . 0.0 107.746 177.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.556 HG23 HD12 ' B' ' 7' ' ' LEU . 0.6 OUTLIER -75.55 -32.01 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 CA-C-N 112.847 -1.978 . . . . 0.0 113.782 -177.818 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.473 ' HB2' HD11 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -69.45 -48.81 59.66 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.185 0.993 . . . . 0.0 109.345 178.011 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.405 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 1.6 t -59.22 -42.93 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.145 -1.843 . . . . 0.0 110.911 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.713 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -44.73 -41.62 6.98 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.331 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.681 ' HB3' ' HG ' ' B' ' 15' ' ' LEU . 8.2 mt -74.87 -33.98 62.16 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.836 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -70.95 -14.7 62.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.44 30.34 2.64 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.706 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -77.57 133.52 38.46 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 178.664 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.563 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 120.724 0.297 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -91.61 116.38 28.83 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 4.9 tp -116.46 139.43 50.46 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.736 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -122.95 123.47 40.99 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.239 178.662 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.59 HG13 HD23 ' B' ' 7' ' ' LEU . 1.3 pt -149.33 179.92 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 71.1 t-105 -93.15 89.47 6.47 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.59 HD23 HG13 ' B' ' 5' ' ' ILE . 1.3 mm? -128.57 100.22 5.67 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.537 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 53.2 p -57.11 170.94 0.41 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 122.119 0.962 . . . . 0.0 112.779 -177.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.55 -40.0 94.79 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.319 -178.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . 0.487 ' O ' ' HB2' ' B' ' 14' ' ' ASP . 3.5 mm-40 -66.53 9.56 0.17 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.623 ' HA ' ' HB3' ' B' ' 14' ' ' ASP . 3.0 t -145.72 19.17 1.48 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' B' ' 8' ' ' SER . 13.0 mt -107.79 -46.4 3.8 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 175.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -88.02 -26.6 22.51 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 114.492 -1.231 . . . . 0.0 108.946 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.623 ' HB3' ' HA ' ' B' ' 11' ' ' THR . 6.5 t70 -55.77 -6.43 0.21 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 113.654 -1.612 . . . . 0.0 113.165 -179.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.772 ' CD2' ' SD ' ' B' ' 29' ' ' MET . 0.0 OUTLIER -135.86 35.06 2.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 121.357 0.599 . . . . 0.0 111.407 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.442 ' HB2' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -51.22 -31.5 20.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.721 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.491 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 9.3 mtpp -62.14 -24.7 67.32 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.078 0.466 . . . . 0.0 110.794 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.754 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 8.6 mtm -86.64 -25.05 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.052 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.713 ' HB3' ' HB2' ' B' ' 29' ' ' MET . . . -100.3 -73.52 0.63 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.719 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.442 ' HD2' ' HB2' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -56.95 -65.05 0.68 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.163 0.506 . . . . 0.0 112.092 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . 0.491 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 13.0 mmp_? -50.54 -27.53 6.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.38 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.761 ' HG2' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -91.65 -23.69 19.76 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.004 179.524 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.82 -5.55 34.76 Favored Glycine 0 C--N 1.34 0.75 0 C-N-CA 121.342 -0.456 . . . . 0.0 112.405 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.761 HD13 ' HG2' ' B' ' 22' ' ' GLU . 53.5 mt -80.59 178.52 8.29 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.664 0.745 . . . . 0.0 112.017 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' B' ' 29' ' ' MET . 3.7 t -120.15 179.9 4.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.723 178.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.82 -38.56 61.47 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.403 ' HA ' HD12 ' A' ' 5' ' ' ILE . 2.3 m -86.36 -51.31 6.31 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 121.91 0.084 . . . . 0.0 111.087 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.46 ' HB3' HD23 ' B' ' 24' ' ' LEU . 1.6 mm-40 -62.88 -9.3 9.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.413 178.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.772 ' SD ' ' CD2' ' B' ' 15' ' ' LEU . 4.9 tpt -79.93 -47.79 14.46 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 123.095 1.426 . . . . 0.0 107.685 177.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.63 ' HA ' HD23 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -79.37 -28.77 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 CA-C-N 112.213 -2.267 . . . . 0.0 114.191 -176.694 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.409 HD21 ' N ' ' B' ' 32' ' ' VAL . 0.2 OUTLIER -70.06 -49.38 51.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.214 1.007 . . . . 0.0 109.087 177.653 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.409 ' N ' HD21 ' B' ' 31' ' ' ASN . 2.0 t -56.94 -47.12 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.1 -1.864 . . . . 0.0 110.266 -179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.706 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -48.84 -37.1 18.47 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.225 178.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.698 HD22 ' CB ' ' A' ' 33' ' ' ALA . 12.9 mt -72.46 -34.87 68.04 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.058 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -79.09 -14.63 59.02 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -130.75 19.87 5.09 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.713 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -73.03 137.02 45.11 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 178.863 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.685 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 1.4 mmpt? . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.718 178.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.29 121.53 24.54 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.3 mm? -126.43 141.65 51.81 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.3 OUTLIER -125.55 117.81 24.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.463 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.561 HG13 ' CD2' ' A' ' 7' ' ' LEU . 4.4 pt -147.33 175.56 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -92.99 98.77 11.57 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 -177.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.627 HD11 HG23 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -119.28 115.38 24.05 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.623 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.0 p -71.58 -134.94 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.442 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.4 t70 -101.21 -41.09 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -73.11 38.97 0.09 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.123 0.487 . . . . 0.0 111.914 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.78 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.7 t -160.59 -43.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.8 mt -68.97 -41.04 78.47 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 175.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.65 -39.74 91.7 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 113.425 -1.716 . . . . 0.0 108.065 176.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.78 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t0 -48.0 -36.6 13.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 114.552 -1.203 . . . . 0.0 109.352 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.74 HD11 HG12 ' A' ' 30' ' ' ILE . 43.0 mt -79.85 27.2 0.3 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.099 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -100.86 -59.08 1.76 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -79.61 -5.93 56.04 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.573 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.48 ' HE2' HD22 ' A' ' 15' ' ' LEU . 43.6 mtm -100.99 -66.05 0.93 Allowed 'General case' 0 C--N 1.341 0.228 0 CA-C-N 116.993 -0.094 . . . . 0.0 110.837 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -29.23 -32.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.388 1.075 . . . . 0.0 113.613 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 18' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.311 -1.081 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.733 177.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 122.105 0.955 . . . . 0.0 112.996 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.462 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 1.7 p -61.4 161.09 9.8 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.509 -1.223 . . . . 0.0 109.714 178.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.87 -41.59 33.74 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.608 ' HA ' HD13 ' B' ' 5' ' ' ILE . 91.7 p -76.47 -51.72 11.22 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.559 ' O ' HG21 ' A' ' 32' ' ' VAL . 6.3 mt-10 -54.89 -31.22 59.72 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.715 ' HE2' HG23 ' A' ' 32' ' ' VAL . 3.5 tpt -64.47 -49.93 69.48 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 123.416 1.579 . . . . 0.0 108.877 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.74 HG12 HD11 ' A' ' 15' ' ' LEU . 0.3 OUTLIER -66.37 -19.39 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.801 0 CA-C-N 113.325 -1.761 . . . . 0.0 112.813 -177.703 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.424 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -79.27 -51.57 9.28 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.634 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.752 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -53.41 -36.17 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.972 0 CA-C-O 121.499 0.666 . . . . 0.0 109.906 178.371 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.804 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.85 -47.68 0.7 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.034 -1.439 . . . . 0.0 111.18 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.663 HD13 HD23 ' B' ' 15' ' ' LEU . 5.6 mt -83.92 -25.41 30.18 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.049 -178.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -87.92 -9.21 54.33 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.241 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.804 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -136.24 22.22 3.22 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.807 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -88.29 140.45 29.46 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.04 0.536 . . . . 0.0 110.702 179.195 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.569 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.458 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.591 0.234 . . . . 0.0 111.61 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -85.41 123.3 30.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.7 mm? -129.12 148.56 51.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.913 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -133.77 121.43 21.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.781 179.176 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.608 HD13 ' HA ' ' A' ' 27' ' ' SER . 5.0 pt -148.89 179.71 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 75.2 t-105 -97.12 101.99 13.67 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -177.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.732 ' CD1' HG21 ' A' ' 30' ' ' ILE . 0.7 OUTLIER -126.86 117.01 21.74 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 18.4 p -73.18 -149.15 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.015 0.436 . . . . 0.0 111.343 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -96.22 -150.2 0.32 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.238 -178.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . 0.417 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 0.9 OUTLIER 35.55 43.15 0.15 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.251 0.62 . . . . 0.0 112.437 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.734 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 4.1 t -172.43 -46.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 19.0 mt -74.19 -39.2 63.33 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -89.63 -36.13 15.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 113.281 -1.781 . . . . 0.0 109.871 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.734 ' HB2' ' N ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -47.67 -25.45 1.2 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.32 -179.089 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.716 ' HB2' ' HB2' ' B' ' 18' ' ' MET . 4.2 pp -83.81 34.18 0.49 Allowed 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 30.3 mm-40 -53.76 -28.21 33.33 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -97.53 -5.94 34.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.716 ' HB2' ' HB2' ' B' ' 15' ' ' LEU . 14.2 mtm -89.84 -80.43 0.31 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.838 0.29 . . . . 0.0 110.562 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.675 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -49.03 -44.42 41.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.783 0.433 . . . . 0.0 111.846 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 2.2 mmm180 -62.74 -68.81 0.3 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 111.807 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -32.6 36.72 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.981 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' B' ' 18' ' ' MET . 21.4 mm-40 -84.9 -11.31 55.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.061 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.64 10.13 75.52 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.281 -177.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.675 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 92.4 mt -83.22 165.08 19.73 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.583 0.706 . . . . 0.0 111.58 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 72.6 p -107.26 164.71 11.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.141 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.13 -37.48 1.44 Allowed 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.529 ' HA ' HD11 ' A' ' 5' ' ' ILE . 3.4 t -82.42 -56.9 3.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.464 ' HB3' HD21 ' B' ' 24' ' ' LEU . 2.7 mm-40 -60.19 -14.22 16.35 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.887 0.375 . . . . 0.0 110.761 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.642 ' SD ' HD21 ' B' ' 15' ' ' LEU . 3.1 tpt -79.23 -46.39 17.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.831 1.3 . . . . 0.0 108.24 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.627 HG23 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -78.06 -31.34 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.104 0 CA-C-N 112.656 -2.066 . . . . 0.0 113.594 -177.26 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -48.38 64.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.24 1.019 . . . . 0.0 109.331 177.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 1.4 t -59.75 -43.0 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 CA-C-N 113.071 -1.877 . . . . 0.0 111.154 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.807 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -46.28 -34.43 4.46 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.114 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.689 HD22 ' HB1' ' A' ' 33' ' ' ALA . 13.5 mt -88.94 -28.48 20.24 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -74.8 -11.01 60.05 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -123.27 27.06 7.69 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.593 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 33.7 t80 -115.99 155.21 28.47 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 111.723 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.427 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.227 178.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.592 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.6 mpt_? . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.951 0.405 . . . . 0.0 111.735 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -107.71 109.23 20.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.56 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.427 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 2.2 tp -127.99 147.21 50.49 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.206 -178.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -108.84 138.21 45.54 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.544 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.57 HG13 HD22 ' A' ' 7' ' ' LEU . 2.1 pt -148.5 -179.9 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.441 ' O ' ' HB2' ' B' ' 27' ' ' SER . 73.0 t-105 -97.13 93.72 6.72 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -177.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.696 ' CD1' HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -125.78 103.67 7.93 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.896 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.555 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.1 p -74.38 -176.11 2.56 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.781 0.8 . . . . 0.0 112.439 -178.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.5 -49.03 65.58 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.689 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -46.05 -34.23 3.96 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.853 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -100.45 -22.38 15.05 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 8' ' ' SER . 59.9 mt -71.55 -39.89 70.36 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 176.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' GLU . 1.3 mm-40 -63.89 -40.61 96.9 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 113.427 -1.715 . . . . 0.0 107.53 175.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.853 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -51.17 -43.29 61.27 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.513 -1.221 . . . . 0.0 108.923 178.138 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.729 HD13 HG12 ' A' ' 30' ' ' ILE . 25.0 mt -86.42 26.43 1.07 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 52.2 mt-10 -106.25 -53.42 2.63 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -76.3 -39.62 53.7 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.369 178.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.543 ' HE2' ' SD ' ' A' ' 29' ' ' MET . 35.4 mtm -68.24 -71.77 0.2 Allowed 'General case' 0 C--N 1.341 0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.655 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 15' ' ' LEU . . . -28.08 -32.09 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.165 1.386 . . . . 0.0 114.302 -178.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.495 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.8 mmm180 . . . . . 0 C--N 1.309 -1.193 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.398 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.553 HD11 HG21 ' A' ' 32' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.268 0 CA-C-O 122.157 0.98 . . . . 0.0 113.052 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 12.9 p -64.02 159.54 19.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.787 178.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.55 -38.84 6.81 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.708 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 22.3 m -81.51 -51.17 8.56 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 111.325 0.121 . . . . 0.0 111.325 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.537 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 4.4 mt-10 -56.56 -27.17 57.16 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.543 ' SD ' ' HE2' ' A' ' 18' ' ' MET . 3.8 tpt -63.26 -47.69 81.33 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 122.951 1.357 . . . . 0.0 108.996 177.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.729 HG12 HD13 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -76.95 -36.74 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.599 0 CA-C-N 112.678 -2.055 . . . . 0.0 114.29 -176.456 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.41 HD21 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -63.5 -47.06 83.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.015 0.912 . . . . 0.0 108.927 178.04 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.553 HG21 HD11 ' A' ' 24' ' ' LEU . 0.9 OUTLIER -59.65 -42.78 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.503 0 CA-C-N 113.431 -1.713 . . . . 0.0 110.795 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.662 ' HB3' ' HB3' ' B' ' 33' ' ' ALA . . . -52.59 -38.92 61.0 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.965 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.575 HD21 ' CB ' ' B' ' 33' ' ' ALA . 13.9 mt -73.98 -29.86 62.19 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.59 -178.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -18.6 54.82 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.965 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -107.0 -36.67 6.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.602 ' CE2' ' HB3' ' B' ' 18' ' ' MET . 2.7 t80 -29.06 134.05 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.259 0.623 . . . . 0.0 111.891 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.853 -1.07 . . . . 0.0 112.892 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -82.4 108.99 16.25 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.0 tp -130.26 145.38 51.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.182 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.0 OUTLIER -103.6 139.61 38.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.552 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.686 ' CD1' HG23 ' A' ' 30' ' ' ILE . 3.5 pt -148.17 179.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.708 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.8 t-105 -98.66 100.36 11.58 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -177.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.523 HD21 HG13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -133.22 114.04 13.36 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 177.378 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.592 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -94.85 -166.35 1.45 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.524 0.678 . . . . 0.0 112.347 -178.244 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -44.93 -63.61 0.88 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.729 -1.123 . . . . 0.0 112.871 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -53.15 -27.23 20.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.627 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 70.0 p -91.08 -34.52 15.05 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' B' ' 8' ' ' SER . 56.2 mt -67.61 -37.96 83.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -43.35 88.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 113.561 -1.654 . . . . 0.0 107.526 176.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.627 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -52.58 -44.02 65.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.406 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.636 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 16.5 mt -76.29 29.64 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -114.56 -57.5 2.26 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.42 -31.56 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.636 178.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.602 ' HB3' ' CE2' ' A' ' 37' ' ' TYR . 7.9 mtm -82.51 -16.15 49.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.866 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.753 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.73 -65.28 0.97 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.858 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mtp-105 -60.89 -65.91 0.62 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.127 0.489 . . . . 0.0 111.533 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.19 -29.87 6.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.863 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.727 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -85.47 -35.31 21.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.631 179.525 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . 0.461 ' N ' ' HG3' ' B' ' 22' ' ' GLU . . . 106.56 67.81 0.67 Allowed Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.919 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.753 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -178.26 -177.34 0.57 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.272 0.558 . . . . 0.0 112.059 178.299 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' SER . . . . . 0.406 ' N ' HD22 ' B' ' 24' ' ' LEU . 19.1 p -110.81 170.75 7.89 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.121 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.449 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.8 mttm -40.88 -38.73 1.0 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -179.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.441 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 1.5 p -79.05 -56.66 4.21 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 117.838 0.29 . . . . 0.0 111.612 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.684 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.1 mt-10 -61.55 -15.63 40.35 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.636 ' HG2' ' HB3' ' B' ' 15' ' ' LEU . 2.7 tpt -77.15 -48.28 18.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 122.743 1.259 . . . . 0.0 108.279 178.141 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.696 HG22 ' CD1' ' A' ' 7' ' ' LEU . 0.4 OUTLIER -75.88 -31.75 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.164 0 CA-C-N 112.885 -1.962 . . . . 0.0 113.462 -177.358 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -68.41 -47.92 66.01 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 122.271 1.034 . . . . 0.0 108.871 177.449 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.429 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.7 t -57.98 -44.69 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.038 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.662 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . . . -49.09 -30.52 6.58 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.033 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.67 HD13 HD13 ' A' ' 15' ' ' LEU . 15.5 mt -80.93 -35.66 32.07 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.996 -177.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -77.86 -11.62 59.91 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -125.19 18.81 8.32 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.651 0.262 . . . . 0.0 111.215 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.42 132.59 38.57 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.767 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.636 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.605 178.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.623 ' HB2' HD23 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -88.4 118.92 28.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.519 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.3 mm? -136.92 148.64 47.11 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.382 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -121.09 130.47 53.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 178.799 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.611 HD11 ' HA ' ' B' ' 27' ' ' SER . 1.3 pt -147.79 -179.79 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.407 ' O ' ' HB2' ' B' ' 27' ' ' SER . 69.3 t-105 -95.2 89.26 5.45 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.636 HD12 HG22 ' B' ' 30' ' ' ILE . 2.1 mm? -120.58 99.36 6.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 p -74.8 -141.04 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.208 -178.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -79.58 -155.33 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.733 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 36.82 43.85 0.31 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.279 0.632 . . . . 0.0 112.412 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.676 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 11.8 t -174.96 -48.2 0.01 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.096 -0.957 . . . . 0.0 112.152 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.46 ' H ' HG23 ' A' ' 11' ' ' THR . 15.1 mt -78.23 -39.71 39.55 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 105.68 -1.97 . . . . 0.0 105.68 175.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -41.9 62.94 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 113.268 -1.787 . . . . 0.0 106.933 176.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.676 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.02 -27.3 7.53 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.017 -1.447 . . . . 0.0 109.569 178.231 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.763 ' CD1' ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -76.64 31.34 0.13 Allowed 'General case' 0 N--CA 1.426 -1.643 0 C-N-CA 124.161 0.984 . . . . 0.0 113.044 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -74.65 -61.52 1.85 Allowed 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.288 -0.257 . . . . 0.0 111.535 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -98.11 7.2 46.65 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.652 ' HB2' HD13 ' A' ' 15' ' ' LEU . 23.2 mtm -88.18 -82.05 0.24 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.879 0.309 . . . . 0.0 111.617 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.63 ' CB ' HD12 ' A' ' 15' ' ' LEU . . . -23.87 -35.78 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 126.444 1.898 . . . . 0.0 114.286 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 18' ' ' MET . 5.0 mtt-85 . . . . . 0 C--N 1.306 -1.283 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.087 179.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.492 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 121.988 0.899 . . . . 0.0 112.671 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.44 ' O ' ' N ' ' A' ' 29' ' ' MET . 1.5 m -70.53 150.3 46.26 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.149 178.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -38.79 -39.43 0.51 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.451 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 m -81.12 -54.96 5.08 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 122.028 0.131 . . . . 0.0 110.734 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -55.32 -29.88 59.15 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.763 ' SD ' ' CD1' ' A' ' 15' ' ' LEU . 4.1 tpt -59.45 -47.49 85.3 Favored 'General case' 0 N--CA 1.44 -0.975 0 CA-C-O 123.028 1.394 . . . . 0.0 109.714 177.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.535 HG22 HD13 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -75.77 -21.39 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.686 0 CA-C-N 112.257 -2.247 . . . . 0.0 113.779 -175.812 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.536 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -78.18 -51.57 10.02 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.983 0.897 . . . . 0.0 109.985 177.164 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.412 ' N ' HD21 ' A' ' 31' ' ' ASN . 1.6 t -63.53 -34.98 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-N 113.705 -1.589 . . . . 0.0 111.155 -179.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.674 ' HB1' ' CB ' ' B' ' 33' ' ' ALA . . . -46.9 -61.45 1.86 Allowed 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.339 -1.301 . . . . 0.0 112.438 -179.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.723 ' N ' ' HB2' ' B' ' 33' ' ' ALA . 0.0 OUTLIER -74.71 -28.09 60.66 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.048 -176.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.605 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 9.2 mt-30 -56.55 -24.4 46.71 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.435 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -125.48 31.53 5.53 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.411 0.624 . . . . 0.0 109.505 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.712 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -87.85 139.38 30.58 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.171 179.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.555 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.123 -0.941 . . . . 0.0 111.187 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.542 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 2.2 ttt-85 . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -73.97 128.08 34.57 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -133.29 140.47 47.47 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.517 -178.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -121.55 130.25 53.41 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.3 pp -150.9 165.0 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -85.48 103.6 14.5 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.761 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.552 ' O ' HD22 ' B' ' 12' ' ' LEU . 1.1 tp -124.69 113.87 18.57 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.456 ' O ' HD22 ' B' ' 12' ' ' LEU . 12.5 p -77.03 -173.44 2.74 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 121.449 0.642 . . . . 0.0 110.74 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.426 ' HA ' HD21 ' B' ' 12' ' ' LEU . 4.7 p-10 -59.41 -155.77 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.562 -1.199 . . . . 0.0 112.528 -178.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . 0.484 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.7 tt0 37.45 39.84 0.19 Allowed 'General case' 0 C--N 1.344 0.349 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.69 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.2 t 177.61 -51.56 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.965 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.623 HD23 ' HB2' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -70.64 -27.56 64.14 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.002 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.31 -43.41 6.96 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.415 -1.72 . . . . 0.0 107.66 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.69 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.7 m-20 -56.17 -16.4 5.18 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.201 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.82 HD12 ' SD ' ' B' ' 29' ' ' MET . 0.1 OUTLIER -70.32 23.58 0.03 OUTLIER 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.84 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' B' ' 14' ' ' ASP . 6.6 mm-40 -87.61 -36.25 17.61 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 11.1 pttm -102.97 -1.92 28.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.723 ' HE2' ' HG ' ' A' ' 34' ' ' LEU . 53.3 mtp -91.45 -84.49 0.26 Allowed 'General case' 0 C--N 1.34 0.182 0 O-C-N 122.259 -0.276 . . . . 0.0 110.45 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.613 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -45.55 -45.28 13.41 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.343 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -69.18 0.24 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 120.966 0.412 . . . . 0.0 111.769 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -33.49 42.77 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -81.3 -12.18 59.13 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.916 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.29 85.58 Favored Glycine 0 C--N 1.34 0.786 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.569 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.613 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 96.5 mt -85.04 174.89 9.38 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.736 0.779 . . . . 0.0 111.392 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 19.4 p -116.58 172.71 7.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.747 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.439 ' HB3' HG23 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -48.96 -34.2 12.49 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.611 ' HA ' HD11 ' A' ' 5' ' ' ILE . 4.6 p -86.56 -54.52 4.35 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.461 ' HB3' HD23 ' B' ' 24' ' ' LEU . 3.0 mt-10 -60.02 -11.17 5.21 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.452 0.168 . . . . 0.0 111.038 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.82 ' SD ' HD12 ' B' ' 15' ' ' LEU . 2.4 tpt -84.36 -46.98 11.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.532 1.158 . . . . 0.0 107.995 177.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.636 HG22 HD12 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -76.38 -29.76 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.139 0 CA-C-N 113.038 -1.892 . . . . 0.0 113.132 -177.359 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.495 ' HB2' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -71.49 -50.92 26.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 122.206 1.003 . . . . 0.0 109.088 177.371 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.439 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 2.0 t -54.82 -41.58 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 CA-C-N 113.164 -1.835 . . . . 0.0 110.16 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.723 ' HB2' ' N ' ' A' ' 34' ' ' LEU . . . -43.36 -43.12 4.93 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.831 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.653 HD22 ' CB ' ' A' ' 33' ' ' ALA . 9.6 mt -79.27 -29.88 42.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.922 -177.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -78.56 -16.32 57.57 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -132.55 21.04 4.29 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.463 0.574 . . . . 0.0 112.293 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.589 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -74.79 139.03 43.01 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.178 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.486 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.853 -0.594 . . . . 0.0 112.474 178.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.669 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 121.146 0.498 . . . . 0.0 112.034 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -114.12 114.36 25.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.529 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.1 tp -129.14 138.42 51.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.429 -177.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -115.97 123.82 48.99 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.612 HG13 ' CD2' ' A' ' 7' ' ' LEU . 3.9 pt -145.85 178.84 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.521 0.564 . . . . 0.0 112.521 -177.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.543 ' CZ3' ' N ' ' B' ' 1' ' ' ARG . 66.0 t-105 -90.91 98.33 11.71 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.612 ' CD2' HG13 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -130.24 107.78 9.54 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.655 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 23.0 t -72.45 -129.95 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -178.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.74 -154.8 0.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -178.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 34.95 45.96 0.18 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.28 0.632 . . . . 0.0 111.885 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.653 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 13.9 t -174.78 -48.37 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.706 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.65 ' CD1' ' HG2' ' B' ' 1' ' ' ARG . 28.4 mt -73.82 -42.5 60.82 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 176.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.07 -38.58 79.11 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 113.368 -1.742 . . . . 0.0 107.442 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.653 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 2.2 t0 -48.72 -33.8 10.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.014 -1.448 . . . . 0.0 110.198 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.637 HD21 ' SD ' ' A' ' 29' ' ' MET . 54.1 mt -69.2 16.67 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -76.23 -61.61 1.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.173 -0.329 . . . . 0.0 110.367 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -83.72 -17.57 40.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.927 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.623 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 10.8 mtm -83.01 -28.47 29.64 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.363 0.125 . . . . 0.0 111.294 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.873 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -98.04 -64.13 1.07 Allowed 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.512 -0.516 0 CA-C-O 120.83 0.347 . . . . 0.0 111.774 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.873 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 120.778 0.323 . . . . 0.0 111.737 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 t -116.43 174.17 6.21 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.18 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.494 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -43.58 -38.63 3.07 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -179.179 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.659 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 1.5 m -76.96 -60.36 2.39 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.567 0.347 . . . . 0.0 111.458 -179.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.637 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.0 mt-10 -58.84 -17.53 24.64 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.716 ' HB2' HD21 ' A' ' 24' ' ' LEU . 2.7 tpt -75.94 -47.7 24.11 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 122.757 1.265 . . . . 0.0 108.471 177.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.494 ' HB ' ' O ' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -74.0 -35.72 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 112.7 -2.046 . . . . 0.0 113.214 -177.213 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.412 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.92 -45.85 76.65 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 122.003 0.906 . . . . 0.0 108.882 176.932 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.493 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -58.91 -41.32 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.575 0 CA-C-N 113.387 -1.733 . . . . 0.0 110.282 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.584 ' HB2' ' HB3' ' B' ' 33' ' ' ALA . . . -52.69 -38.27 60.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.99 178.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.603 HD23 ' CB ' ' B' ' 33' ' ' ALA . 17.8 mt -71.66 -30.41 65.68 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.074 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -79.79 -17.19 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.387 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.56 24.4 4.75 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.71 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -77.51 125.09 28.78 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.72 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.092 -0.956 . . . . 0.0 111.343 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.655 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -88.97 134.76 33.86 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.7 tp -129.34 142.51 50.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.606 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -125.85 127.5 46.16 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.368 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.4 pp -154.37 169.56 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.659 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 66.5 t-105 -80.88 113.92 19.41 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.409 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 15.1 tp -144.96 102.26 3.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -178.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.669 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 14.0 p -79.29 178.08 8.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -176.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.422 ' HB2' ' NH2' ' A' ' 1' ' ' ARG . 9.3 t70 -51.74 -50.63 60.23 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 113.093 -1.867 . . . . 0.0 112.497 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -47.74 -27.82 2.17 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.603 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 22.2 p -100.32 -22.78 14.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' B' ' 8' ' ' SER . 31.2 mt -79.21 -42.3 26.33 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 178.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.496 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.0 mt-10 -62.04 -41.72 98.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.033 -1.439 . . . . 0.0 107.507 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.603 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.75 -45.4 58.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.325 -1.307 . . . . 0.0 109.699 178.171 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.805 HD11 ' CG ' ' B' ' 18' ' ' MET . 1.2 mm? -82.53 22.2 0.89 Allowed 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.619 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.2 OUTLIER -80.34 -47.93 13.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.819 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.619 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 24.3 mtpp -102.92 -10.81 18.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.837 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.805 ' CG ' HD11 ' B' ' 15' ' ' LEU . 0.1 OUTLIER -105.86 4.64 29.92 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.027 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.843 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -99.76 -15.22 18.54 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.883 -0.51 . . . . 0.0 112.367 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 -77.89 -97.9 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.61 -27.63 62.92 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.922 0.391 . . . . 0.0 110.59 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' B' ' 18' ' ' MET . 24.4 mm-40 -101.95 -21.12 14.58 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . 0.843 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -102.51 -20.59 11.73 Favored Glycine 0 N--CA 1.467 0.706 0 C-N-CA 119.907 -1.14 . . . . 0.0 113.09 -179.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.848 ' CD2' ' HB3' ' B' ' 28' ' ' GLU . 0.0 OUTLIER 44.84 27.96 0.31 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 179.146 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' SER . . . . . 0.721 ' HB2' ' HB2' ' B' ' 28' ' ' GLU . 0.5 OUTLIER 132.1 142.06 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 127.659 2.384 . . . . 0.0 109.449 177.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -45.84 -50.8 13.85 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 117.676 0.216 . . . . 0.0 111.206 -178.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.594 ' HA ' HD12 ' A' ' 5' ' ' ILE . 73.4 p -81.43 -35.71 30.31 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.594 0.235 . . . . 0.0 110.869 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.848 ' HB3' ' CD2' ' B' ' 24' ' ' LEU . 13.4 mm-40 -61.72 -26.93 68.36 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.035 179.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.804 ' HG2' ' HG ' ' B' ' 15' ' ' LEU . 0.0 OUTLIER -68.12 -38.18 81.96 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-O 122.534 1.159 . . . . 0.0 109.263 178.52 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.565 HG22 ' CD1' ' A' ' 7' ' ' LEU . 0.3 OUTLIER -80.17 -30.66 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.5 0 CA-C-N 112.999 -1.909 . . . . 0.0 112.837 -175.363 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -44.8 86.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.474 HG21 HD13 ' B' ' 24' ' ' LEU . 2.1 t -58.41 -48.34 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.375 0 CA-C-N 112.422 -2.172 . . . . 0.0 111.854 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.603 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -47.14 -40.57 15.94 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.557 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.611 HD11 HD23 ' A' ' 15' ' ' LEU . 12.3 mt -75.73 -32.11 59.89 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.157 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 11.8 mt-30 -78.47 -15.15 58.94 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 25.9 m80 -122.28 6.15 9.67 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.511 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -64.7 139.31 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.688 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 123.396 0.678 . . . . 0.0 112.368 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.545 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 1.2 ttt-85 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -73.18 123.36 23.49 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 178.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.505 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 2.2 tp -131.01 149.32 52.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.791 -178.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -118.33 132.32 56.28 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.995 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.706 ' CD1' HG21 ' B' ' 30' ' ' ILE . 3.6 pt -147.53 176.54 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.52 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 72.2 t-105 -96.57 103.59 15.51 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -177.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.52 HD22 HG13 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -131.86 113.63 13.7 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.636 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.639 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 12.6 p -79.17 -176.85 5.35 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.727 0.775 . . . . 0.0 112.707 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -47.16 -60.42 2.49 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.369 -1.287 . . . . 0.0 112.552 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -50.61 -25.88 4.7 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.54 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 23.6 p -94.21 -34.08 13.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.7 mt -65.43 -41.13 93.84 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.42 -43.95 97.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 113.846 -1.524 . . . . 0.0 108.508 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.535 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -55.23 -50.05 70.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.491 179.081 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.73 ' CD1' HG12 ' A' ' 30' ' ' ILE . 14.2 mt -75.07 17.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 10.3 mm-40 -115.31 -56.35 2.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.1 mttp -76.23 -31.64 58.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.042 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.498 ' HE3' ' HE2' ' A' ' 29' ' ' MET . 0.7 OUTLIER -97.88 21.12 11.01 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.184 0.516 . . . . 0.0 111.425 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.656 ' HA ' HD21 ' A' ' 24' ' ' LEU . . . -110.97 -64.72 1.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER . . . . . 0 CA--C 1.514 -0.416 0 CA-C-O 121.162 0.506 . . . . 0.0 111.542 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.694 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.416 0 CA-C-O 121.567 0.699 . . . . 0.0 112.316 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.519 ' N ' HD22 ' A' ' 24' ' ' LEU . 3.3 t -117.65 -179.42 3.73 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.559 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -45.06 -38.2 4.78 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.566 ' HA ' HD12 ' B' ' 5' ' ' ILE . 12.0 m -78.01 -62.57 1.63 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.694 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 4.4 mt-10 -59.99 -14.49 16.35 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.782 ' HE3' HG22 ' A' ' 32' ' ' VAL . 2.1 tpt -78.44 -47.12 18.16 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 123.791 1.758 . . . . 0.0 107.115 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.73 HG12 ' CD1' ' A' ' 15' ' ' LEU . 0.5 OUTLIER -64.84 -20.81 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.69 0 CA-C-N 113.065 -1.879 . . . . 0.0 112.19 -179.131 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.47 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -79.39 -52.52 7.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.152 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.782 HG22 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -52.05 -33.21 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.848 0 CA-C-O 121.462 0.649 . . . . 0.0 110.395 178.525 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.843 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.2 -43.01 0.33 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.822 -1.535 . . . . 0.0 111.059 178.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.717 HD12 HD22 ' B' ' 15' ' ' LEU . 7.1 mt -84.63 -35.2 22.83 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.425 -179.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -69.16 -25.6 64.44 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.843 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 6.9 p-80 -101.15 -29.58 12.04 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.712 0.687 . . . . 0.0 112.474 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.671 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 9.1 t80 -50.68 144.07 8.67 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 117.917 -1.04 . . . . 0.0 112.251 178.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.639 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 121.034 0.445 . . . . 0.0 111.809 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -110.06 116.29 31.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.137 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.2 mm? -131.9 150.66 52.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.258 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -117.17 132.78 56.57 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.579 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.566 HD12 ' HA ' ' A' ' 27' ' ' SER . 1.3 pt -151.52 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 72.2 t-105 -94.89 97.02 9.7 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -177.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.662 ' HB3' HG21 ' B' ' 11' ' ' THR . 2.2 mm? -130.38 108.09 9.73 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 27.5 t -67.96 -125.78 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -176.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.427 ' C ' ' H ' ' B' ' 11' ' ' THR . 14.4 t70 -101.1 -40.12 7.35 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -176.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -72.34 39.69 0.08 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.662 HG21 ' HB3' ' B' ' 7' ' ' LEU . 6.5 t -162.19 -41.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.514 ' N ' HG22 ' B' ' 11' ' ' THR . 20.2 mt -74.37 -42.67 58.92 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.23 -37.78 72.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.567 -1.651 . . . . 0.0 108.151 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.656 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.2 t70 -45.38 -33.68 2.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.723 HD23 ' CG ' ' B' ' 29' ' ' MET . 41.5 mt -82.47 27.51 0.5 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -97.71 -51.63 4.03 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -82.84 -17.29 44.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.506 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.49 ' HA ' ' HB2' ' B' ' 22' ' ' GLU . 14.3 mtm -92.23 -70.19 0.71 Allowed 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.314 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.756 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -28.68 -31.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.916 1.286 . . . . 0.0 114.358 -178.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.46 ' N ' ' O ' ' B' ' 18' ' ' MET . 9.0 mtp-105 -67.19 -121.71 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.918 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 tpp85 -52.46 -23.96 7.08 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.915 -0.491 . . . . 0.0 111.645 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.49 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 0.8 OUTLIER -108.08 -1.65 20.25 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -177.519 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . 0.756 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -151.01 20.43 0.97 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 115.623 -3.179 . . . . 0.0 117.912 -176.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.577 HD12 HG23 ' B' ' 32' ' ' VAL . 1.1 mp 50.26 -157.33 0.09 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 120.108 1.954 . . . . 0.0 113.254 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -64.57 162.65 15.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.681 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.44 -44.58 17.47 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.52 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 14.8 m -82.91 -47.91 11.28 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.165 0.061 . . . . 0.0 111.165 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.457 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 2.6 mt-10 -55.61 -28.31 54.51 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.738 ' SD ' ' HA3' ' B' ' 23' ' ' GLY . 3.9 tpt -63.61 -48.69 76.3 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.682 1.229 . . . . 0.0 109.537 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.715 HG12 HD11 ' B' ' 15' ' ' LEU . 0.3 OUTLIER -77.54 -30.32 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.668 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.877 -176.289 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.455 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -68.51 -48.12 65.2 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.044 177.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.577 HG23 HD12 ' B' ' 24' ' ' LEU . 1.4 t -58.37 -43.85 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-N 113.314 -1.766 . . . . 0.0 110.675 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.671 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -51.34 -32.75 26.68 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.783 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.649 HD23 ' HB3' ' A' ' 33' ' ' ALA . 11.2 mt -83.82 -28.99 27.67 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.889 -178.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -74.51 -16.24 60.84 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.278 0.474 . . . . 0.0 112.278 -179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.9 m80 -123.05 42.22 3.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.788 0.328 . . . . 0.0 111.104 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.717 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.6 OUTLIER -58.14 133.13 55.33 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.423 0.63 . . . . 0.0 112.108 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.637 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 4.2 tptt . . . . . 0 C--O 1.249 1.072 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.675 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.508 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.795 0 CA-C-O 120.688 0.28 . . . . 0.0 111.718 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -95.19 110.77 22.69 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.4 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 3.0 tp -123.39 145.54 48.69 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.513 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -117.32 134.99 54.17 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.56 HD13 HD21 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -157.15 177.68 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.435 ' O ' HD11 ' A' ' 7' ' ' LEU . 69.8 t-105 -91.34 101.04 13.73 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.674 HD12 HG23 ' B' ' 30' ' ' ILE . 0.4 OUTLIER -125.56 106.59 9.87 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.378 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.454 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.1 t -85.57 -137.0 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.921 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.82 -157.33 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.566 0.209 . . . . 0.0 111.566 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 35.05 43.96 0.12 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.34 0.656 . . . . 0.0 112.247 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.645 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.85 -51.21 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.598 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.521 ' N ' HG21 ' A' ' 11' ' ' THR . 16.5 mt -72.22 -40.58 67.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 2.7 mt-10 -74.98 -40.9 60.46 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.195 -1.82 . . . . 0.0 107.982 175.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.645 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -51.44 -27.61 10.77 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 114.625 -1.171 . . . . 0.0 109.948 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.832 HD13 ' SD ' ' A' ' 29' ' ' MET . 0.2 OUTLIER -80.8 36.19 0.38 Allowed 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 124.286 1.035 . . . . 0.0 112.927 -179.684 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 13.3 mt-10 -79.79 -59.15 2.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.271 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -101.98 23.42 11.51 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.705 ' HB2' HD13 ' A' ' 15' ' ' LEU . 6.5 mtm -103.85 -86.25 0.45 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.186 -0.321 . . . . 0.0 110.922 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.726 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -45.75 -44.75 14.04 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.088 0.555 . . . . 0.0 111.507 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.361 0 CA-C-O 120.993 0.425 . . . . 0.0 111.664 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.726 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 99.2 mt . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.493 0.663 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -120.81 167.79 12.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.334 177.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.41 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 2.4 mttm -43.19 -38.61 2.57 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.686 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.1 m -84.3 -54.76 4.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.485 ' HB3' HD23 ' A' ' 24' ' ' LEU . 3.3 mm-40 -62.09 -9.87 8.61 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.191 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.832 ' SD ' HD13 ' A' ' 15' ' ' LEU . 2.5 tpt -87.22 -46.98 9.23 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.616 1.198 . . . . 0.0 108.123 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.627 HG12 HD23 ' B' ' 34' ' ' LEU . 0.7 OUTLIER -75.56 -34.37 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.127 0 CA-C-N 112.948 -1.933 . . . . 0.0 112.773 -177.83 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.443 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -65.75 -48.08 73.07 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.327 1.06 . . . . 0.0 108.905 177.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.443 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 1.2 t -60.38 -40.81 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 CA-C-N 112.932 -1.94 . . . . 0.0 111.098 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.755 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -46.33 -43.98 16.41 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.885 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.567 HD13 ' CD2' ' B' ' 15' ' ' LEU . 10.5 mt -80.11 -29.41 38.99 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.809 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -66.78 -19.06 65.67 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.33 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -120.7 43.53 2.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.121 0.486 . . . . 0.0 109.908 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.597 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 70.3 t80 -80.74 161.39 24.59 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.777 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.698 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 5.3 mmpt? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.244 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.42 0.153 . . . . 0.0 111.283 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -86.12 121.56 28.9 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 mm? -138.44 153.55 48.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.301 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -113.27 129.85 56.41 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.223 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.595 ' CD1' HG23 ' A' ' 30' ' ' ILE . 3.9 pt -141.38 173.74 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.686 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 71.4 t-105 -99.43 97.71 8.71 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.549 ' CD2' HG13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -125.3 105.63 9.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.561 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.415 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 8.7 p -79.41 -164.36 0.63 Allowed 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 121.607 0.717 . . . . 0.0 112.207 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.414 ' O ' ' HG3' ' B' ' 13' ' ' GLU . 15.9 m-20 -64.47 -44.23 91.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.285 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -64.06 5.68 0.23 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.68 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.2 p -125.2 -42.89 1.97 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' B' ' 8' ' ' SER . 25.5 mt -68.86 -40.81 79.1 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.47 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.1 mt-10 -66.33 -40.27 89.78 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.144 176.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.68 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.09 -36.7 30.49 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.836 178.574 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.71 ' CD1' ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.35 31.19 0.34 Allowed 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.298 -179.492 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.47 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 4.5 pt-20 -79.52 -46.41 17.44 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.416 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 3.7 ptpp? -108.36 -4.8 17.1 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.602 ' HB2' HD11 ' B' ' 15' ' ' LEU . 22.1 mtp -83.89 -74.23 0.38 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.898 0.317 . . . . 0.0 111.812 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.719 ' HA ' ' CA ' ' B' ' 23' ' ' GLY . . . -26.61 -33.87 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.789 1.636 . . . . 0.0 114.015 -177.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' B' ' 18' ' ' MET . 8.7 mtp-105 -66.9 -114.13 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.193 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -58.92 -21.35 57.66 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.579 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 2.4 mt-10 -113.0 -5.86 13.77 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . 0.719 ' CA ' ' HA ' ' B' ' 19' ' ' ALA . . . -143.92 16.55 2.17 Favored Glycine 0 CA--C 1.502 -0.72 0 C-N-CA 116.442 -2.79 . . . . 0.0 116.719 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' B' ' 19' ' ' ALA . 1.2 mp 52.74 -162.51 0.09 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 119.271 1.536 . . . . 0.0 112.926 176.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.8 m -62.48 157.69 19.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.102 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -40.42 23.49 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 117.594 0.179 . . . . 0.0 111.149 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -77.55 -50.34 12.78 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.619 0.247 . . . . 0.0 110.558 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.464 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 0.8 OUTLIER -58.19 -30.91 66.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.278 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.733 ' HE3' ' CG2' ' B' ' 32' ' ' VAL . 2.3 tpt -63.4 -46.13 87.83 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 123.854 1.787 . . . . 0.0 108.752 177.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.674 HG23 HD12 ' A' ' 7' ' ' LEU . 0.4 OUTLIER -67.65 -15.96 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.151 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.998 -177.385 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -47.43 12.16 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 176.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.738 ' HB ' ' CD2' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -57.79 -32.88 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.212 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.656 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 1.01 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.17 -43.91 1.13 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 113.899 -1.5 . . . . 0.0 110.884 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.627 HD23 HG12 ' A' ' 30' ' ' ILE . 8.8 mt -80.64 -31.05 36.62 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.437 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' B' ' 32' ' ' VAL . 4.3 mt-30 -87.14 -12.8 45.94 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 1.01 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -118.34 6.39 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 179.526 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.755 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -78.28 141.83 38.24 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.901 0.48 . . . . 0.0 110.468 179.547 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.449 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.903 -1.046 . . . . 0.0 112.039 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.524 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -72.4 124.35 24.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.499 HD23 ' CD2' ' B' ' 12' ' ' LEU . 1.4 tp -131.27 149.41 52.58 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.745 -178.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -117.95 128.47 54.83 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.645 ' CD1' HG22 ' B' ' 30' ' ' ILE . 4.6 pt -145.35 173.91 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.478 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 75.1 t-105 -98.83 108.99 21.82 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.619 ' O ' HD21 ' A' ' 12' ' ' LEU . 0.7 OUTLIER -124.94 121.38 34.3 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.709 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.432 ' O ' ' HB3' ' A' ' 12' ' ' LEU . 15.6 p -80.84 178.73 8.2 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-O 121.704 0.764 . . . . 0.0 110.885 -179.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.579 ' HA ' HD23 ' A' ' 12' ' ' LEU . 14.2 t70 -59.63 -43.26 93.9 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.932 -178.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -78.25 40.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 111.642 -179.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.703 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 10.3 t -174.75 -51.73 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.961 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.623 HD22 ' CD ' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -58.52 -30.41 67.04 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.33 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -92.88 -37.1 12.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.042 -1.436 . . . . 0.0 109.216 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.703 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.3 t70 -45.41 -35.32 3.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.517 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.667 HD13 HG12 ' A' ' 30' ' ' ILE . 45.6 mt -58.12 -11.31 2.46 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.24 -61.51 1.98 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -63.65 -21.53 66.43 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.726 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.629 ' SD ' ' HA ' ' A' ' 15' ' ' LEU . 7.0 mtp -83.89 -76.42 0.29 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.01 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.703 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.89 -43.06 2.93 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.028 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 mtp85 . . . . . 0 CA--C 1.517 -0.316 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.179 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.703 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 97.8 mt . . . . . 0 N--CA 1.45 -0.464 0 CA-C-O 121.583 0.706 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -114.84 166.73 11.45 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.425 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.64 -39.09 3.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' B' ' 6' ' ' TRP . 2.1 p -84.09 -52.92 5.9 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.436 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.5 mm-40 -62.48 -11.29 15.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.45 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.687 ' HE3' HG23 ' A' ' 32' ' ' VAL . 2.3 tpt -87.69 -48.28 7.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.41 1.576 . . . . 0.0 107.324 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.667 HG12 HD13 ' A' ' 15' ' ' LEU . 0.6 OUTLIER -68.08 -24.09 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.555 0 CA-C-N 113.571 -1.65 . . . . 0.0 112.143 -179.071 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.464 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -76.17 -46.4 28.7 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 177.155 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.797 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -57.43 -36.09 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.975 0 CA-C-O 121.57 0.7 . . . . 0.0 109.658 178.397 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.861 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -37.04 -47.27 0.72 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.193 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.58 ' HB3' ' HE3' ' B' ' 18' ' ' MET . 7.8 mt -83.36 -28.86 28.68 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.967 -178.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -86.64 -10.56 53.57 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.861 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -128.96 15.94 6.28 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.698 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -81.89 142.51 32.43 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.118 0.567 . . . . 0.0 109.54 178.505 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.463 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.164 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.881 178.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.623 ' CD ' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -87.83 116.73 26.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -132.34 155.82 47.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.549 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -122.23 130.66 53.39 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.569 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.523 HD13 ' CG2' ' A' ' 30' ' ' ILE . 1.4 pt -150.63 -178.27 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.404 ' O ' ' HB2' ' A' ' 27' ' ' SER . 73.7 t-105 -94.6 93.26 7.48 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -177.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.575 HD12 ' CG2' ' A' ' 30' ' ' ILE . 1.6 mm? -125.12 110.76 14.52 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 25.7 t -68.35 -126.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.423 ' C ' ' H ' ' B' ' 11' ' ' THR . 13.3 t70 -103.63 -41.04 6.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -72.35 41.42 0.09 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.847 0.459 . . . . 0.0 111.95 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.665 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 6.6 t -163.44 -43.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.555 ' N ' HG21 ' B' ' 11' ' ' THR . 22.8 mt -72.65 -41.65 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.1 mt-10 -74.23 -36.04 63.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.346 -1.752 . . . . 0.0 108.541 176.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.665 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.3 t70 -46.72 -36.45 7.19 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.496 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.726 HD12 HG12 ' B' ' 30' ' ' ILE . 47.5 mt -71.51 -2.75 17.9 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.435 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.6 OUTLIER -72.3 -36.99 69.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.922 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -91.79 -9.68 42.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.426 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.58 ' HE3' ' HB3' ' A' ' 34' ' ' LEU . 6.6 mtm -100.42 -76.46 0.55 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.105 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.647 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -41.09 -44.36 2.45 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 122.595 0.358 . . . . 0.0 111.4 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.449 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.6 mmm180 -64.03 -68.57 0.34 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.028 0.442 . . . . 0.0 111.901 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -52.6 -29.68 27.21 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.252 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -90.55 -8.56 49.93 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.43 7.61 73.56 Favored Glycine 0 C--N 1.342 0.871 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.897 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.647 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.0 mt -85.67 172.88 10.53 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.525 0.679 . . . . 0.0 111.42 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -110.25 165.06 12.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.482 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.9 -41.97 12.07 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.478 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 74.6 m -84.84 -48.19 9.6 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.717 0.266 . . . . 0.0 111.717 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -64.81 -10.29 26.9 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.596 0.236 . . . . 0.0 111.223 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.569 ' CG ' ' CD2' ' B' ' 15' ' ' LEU . 3.8 tpt -85.89 -47.51 9.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.726 HG12 HD12 ' B' ' 15' ' ' LEU . 0.5 OUTLIER -73.54 -35.15 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.065 0 CA-C-N 113.092 -1.867 . . . . 0.0 113.151 -178.527 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.401 HD21 ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -65.67 -47.2 76.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.384 1.088 . . . . 0.0 109.165 177.811 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.401 ' N ' HD21 ' B' ' 31' ' ' ASN . 1.5 t -59.49 -45.23 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.051 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.698 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -47.61 -37.2 12.09 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.764 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.678 HD23 ' HB2' ' A' ' 33' ' ' ALA . 10.9 mt -81.43 -27.86 34.51 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -81.28 -13.67 58.21 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -178.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -117.46 29.67 7.74 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 118.002 0.365 . . . . 0.0 111.865 178.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.525 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 24.0 t80 -124.16 157.55 34.45 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.792 0.329 . . . . 0.0 111.649 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.469 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.016 -0.992 . . . . 0.0 112.164 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 120.367 0.127 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -82.83 120.89 26.22 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.465 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 mm? -131.18 151.39 51.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.625 -178.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.998 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -128.59 123.86 34.42 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.501 178.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.541 HG13 HD21 ' A' ' 7' ' ' LEU . 4.0 pt -146.76 176.18 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -178.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -95.65 102.46 14.26 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -177.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.636 HD12 HG23 ' B' ' 30' ' ' ILE . 0.9 OUTLIER -129.63 112.08 13.33 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.839 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.554 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 11.2 p -79.65 -178.27 6.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.895 0.855 . . . . 0.0 112.697 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -49.6 -56.43 10.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.8 -1.546 . . . . 0.0 113.036 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -44.96 -33.81 2.16 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.849 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t -96.87 -22.23 17.02 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 8' ' ' SER . 66.2 mt -73.66 -39.9 64.11 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 175.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.72 -40.17 96.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.452 175.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.849 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t0 -50.42 -45.49 55.8 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.466 177.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.747 ' HB3' ' HG2' ' A' ' 29' ' ' MET . 19.3 mt -89.75 30.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.833 179.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.557 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -113.53 -50.36 2.85 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.839 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.557 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 53.6 mttm -88.66 -29.92 19.55 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.145 179.317 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.499 ' O ' ' HG3' ' A' ' 18' ' ' MET . 1.1 ptt? -99.13 15.94 24.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.682 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.523 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -99.57 -18.73 17.22 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 . . . . . 0 C--N 1.317 -0.831 0 O-C-N 121.428 -0.795 . . . . 0.0 110.107 -179.595 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.613 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 122.654 1.216 . . . . 0.0 114.214 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -55.81 152.86 9.14 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.002 -1.454 . . . . 0.0 110.602 179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -41.79 2.95 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 120.571 0.224 . . . . 0.0 111.208 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.592 ' HA ' HD13 ' B' ' 5' ' ' ILE . 1.1 m -76.64 -51.38 11.67 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.568 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.613 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.4 mt-10 -54.53 -35.74 63.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.693 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.747 ' HG2' ' HB3' ' A' ' 15' ' ' LEU . 3.6 tpt -59.36 -45.58 91.01 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.802 1.763 . . . . 0.0 108.845 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.744 HG12 ' CD1' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -66.36 -20.79 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.711 0 CA-C-N 112.953 -1.931 . . . . 0.0 112.713 -177.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.449 ' HB2' HD13 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -80.39 -47.76 13.93 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.348 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.723 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -58.74 -32.08 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.095 0 CA-C-O 121.681 0.753 . . . . 0.0 109.138 178.468 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 1.008 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.1 -47.15 1.51 Allowed 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 113.741 -1.572 . . . . 0.0 111.225 178.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.593 HD13 ' CD2' ' B' ' 15' ' ' LEU . 9.3 mt -81.53 -25.02 36.26 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.74 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.433 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -91.78 -8.62 46.24 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 1.008 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -125.78 16.31 8.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.732 0.413 . . . . 0.0 111.965 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.803 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -87.9 137.53 32.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.118 0.567 . . . . 0.0 111.686 -179.194 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.601 -0.714 . . . . 0.0 111.324 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -81.43 120.48 25.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -128.45 145.17 51.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.659 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.998 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -124.4 123.16 39.56 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.484 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.592 HD13 ' HA ' ' A' ' 27' ' ' SER . 2.6 pt -147.76 -179.35 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -98.98 102.51 14.26 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -176.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.563 HD11 ' CG2' ' A' ' 30' ' ' ILE . 1.8 mm? -129.44 109.56 11.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 13.2 t -78.23 -132.5 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.7 -155.52 0.39 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . 0.411 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.8 mm-40 37.73 45.71 0.67 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.579 0.751 . . . . 0.0 112.637 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.692 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 9.3 t -179.17 -47.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.936 178.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 38.4 mt -69.17 -40.3 78.21 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -68.98 -39.12 79.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.275 176.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.692 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 3.2 t70 -47.96 -33.67 8.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.539 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.652 HD22 ' SD ' ' B' ' 29' ' ' MET . 57.9 mt -64.68 -5.3 5.43 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 14.5 mt-10 -62.4 -55.87 23.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.228 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.3 pttm -79.78 1.11 27.98 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.154 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.598 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 12.0 mtm -107.43 -83.11 0.54 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 111.609 0.226 . . . . 0.0 111.609 -179.154 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.709 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -43.53 -43.61 5.6 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 16.6 mtp85 -70.2 -66.0 0.65 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.976 0.417 . . . . 0.0 111.461 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.26 -32.45 37.27 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.283 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.494 ' HB2' ' O ' ' B' ' 18' ' ' MET . 21.9 mm-40 -88.44 -10.54 48.8 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.295 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.86 7.3 80.69 Favored Glycine 0 C--N 1.339 0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.502 -178.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.709 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 96.2 mt -80.27 171.51 14.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.578 0.704 . . . . 0.0 111.408 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -112.19 165.0 12.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.404 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.6 -40.0 5.43 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.0 m -83.32 -52.23 6.74 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.418 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.2 mt-10 -63.79 -11.04 23.36 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.756 -0.202 . . . . 0.0 110.958 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.652 ' SD ' HD22 ' B' ' 15' ' ' LEU . 3.0 tpt -85.16 -47.05 10.51 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 122.742 1.258 . . . . 0.0 107.704 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.636 HG23 HD12 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -75.13 -32.59 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.04 0 CA-C-N 112.889 -1.959 . . . . 0.0 113.216 -178.008 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.466 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -70.32 -50.45 39.07 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.121 0.962 . . . . 0.0 109.449 178.181 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.466 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -55.97 -42.9 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 113.219 -1.809 . . . . 0.0 110.264 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.803 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -49.44 -30.88 8.72 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.288 -1.323 . . . . 0.0 112.232 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.596 HD12 HD22 ' A' ' 15' ' ' LEU . 10.8 mt -89.66 -32.88 16.85 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -177.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -72.12 -13.45 61.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -116.52 40.84 2.8 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.619 ' HD1' ' CE1' ' A' ' 36' ' ' HIS . 63.0 t80 -83.5 163.73 20.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.9 -178.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.563 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.282 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.812 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.063 0.459 . . . . 0.0 111.757 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -105.01 113.79 27.6 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.4 tp -122.71 142.57 50.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.944 -178.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -123.68 129.58 51.34 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.121 178.486 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.579 HG13 HD22 ' A' ' 7' ' ' LEU . 2.1 pt -148.67 179.22 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.407 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.404 ' O ' ' HB3' ' B' ' 27' ' ' SER . 71.1 t-105 -96.2 90.41 5.48 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.658 HD12 HG21 ' B' ' 30' ' ' ILE . 1.9 mm? -119.16 101.26 7.87 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.447 ' HA ' ' HB2' ' B' ' 1' ' ' ARG . 51.6 p -74.76 -135.2 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.187 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.44 -156.68 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.338 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 34.32 43.68 0.09 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.355 0.662 . . . . 0.0 112.465 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.692 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -172.19 -48.88 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.932 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 8' ' ' SER . 15.3 mt -75.85 -41.25 52.96 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -77.17 -39.99 46.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.317 176.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.692 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -51.05 -24.75 4.09 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.078 178.549 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.777 HD11 ' HB2' ' A' ' 18' ' ' MET . 0.1 OUTLIER -77.45 41.96 0.33 Allowed 'General case' 0 N--CA 1.424 -1.767 0 C-N-CA 124.24 1.016 . . . . 0.0 112.637 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.649 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -91.15 -47.91 7.26 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.342 179.926 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.649 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 5.3 mtpm? -102.88 24.8 10.14 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.777 ' HB2' HD11 ' A' ' 15' ' ' LEU . 16.6 mtp -116.51 -86.05 0.62 Allowed 'General case' 0 C--O 1.223 -0.34 0 O-C-N 122.172 -0.33 . . . . 0.0 111.201 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.683 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -42.0 -45.43 3.85 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.133 0.573 . . . . 0.0 111.188 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.409 ' HD2' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.382 0 CA-C-O 121.147 0.498 . . . . 0.0 111.476 179.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.683 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 98.4 mt . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.579 0.704 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -116.96 168.6 10.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.371 177.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.457 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -45.41 -37.89 5.5 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.066 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.405 ' HA ' ' HB ' ' B' ' 5' ' ' ILE . 58.8 m -80.39 -57.39 3.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.442 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.549 ' O ' HG23 ' A' ' 32' ' ' VAL . 1.8 mm-40 -60.75 -16.21 37.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.137 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.778 ' HE1' HG22 ' A' ' 32' ' ' VAL . 2.4 tpt -82.15 -45.61 14.92 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-O 123.704 1.716 . . . . 0.0 107.853 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.556 HG22 HD13 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -66.2 -19.48 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.99 0 CA-C-N 113.355 -1.748 . . . . 0.0 111.615 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.439 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -78.1 -53.29 7.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.778 HG22 ' HE1' ' A' ' 29' ' ' MET . 0.0 OUTLIER -51.69 -32.51 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.711 0 CA-C-O 121.584 0.707 . . . . 0.0 109.548 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.911 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -40.05 -43.39 1.57 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.93 -1.486 . . . . 0.0 111.064 177.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.721 HD13 ' HB ' ' B' ' 11' ' ' THR . 6.8 mt -80.67 -29.08 36.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.824 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' A' ' 32' ' ' VAL . 8.8 mt-30 -79.08 -30.69 44.03 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.911 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 10.0 p-80 -92.05 -35.67 13.8 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 119.049 0.841 . . . . 0.0 111.895 178.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.704 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 8.1 t80 -46.53 140.44 4.34 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.607 0.242 . . . . 0.0 111.179 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.47 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 117.972 -1.013 . . . . 0.0 112.108 178.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.447 ' HB2' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.384 0.135 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -82.32 119.45 24.14 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -126.37 134.25 51.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.525 -178.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -112.25 131.01 55.73 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.032 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.647 HD13 HD13 ' B' ' 7' ' ' LEU . 2.5 pp -153.73 169.98 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -89.04 100.44 13.22 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -178.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.647 HD13 HD13 ' B' ' 5' ' ' ILE . 1.9 mp -135.17 114.66 12.56 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.812 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -91.93 -169.86 2.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.095 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -43.41 -60.09 1.86 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.126 -1.397 . . . . 0.0 112.869 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.58 -24.72 0.94 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.721 ' HB ' HD13 ' A' ' 34' ' ' LEU . 20.4 p -103.34 -27.41 12.47 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' B' ' 8' ' ' SER . 35.7 mt -74.22 -40.57 62.36 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -62.73 -41.04 98.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.34 176.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.566 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -48.91 -40.41 29.88 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.522 179.132 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.691 HD21 HD12 ' A' ' 34' ' ' LEU . 26.3 mt -78.83 32.34 0.2 Allowed 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.494 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 44.9 mt-10 -103.1 -55.09 2.48 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.428 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 50.2 mttp -81.49 -25.15 36.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.433 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.808 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 9.5 mtm -86.2 -21.91 27.23 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.3 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.7 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.95 -68.4 0.83 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.828 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -57.8 -66.38 0.48 Allowed 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.011 0.434 . . . . 0.0 112.067 -179.599 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . 0.428 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -49.53 -34.18 16.72 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.368 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.518 ' HB2' ' O ' ' B' ' 18' ' ' MET . 20.2 mm-40 -85.08 -10.7 56.59 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.243 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.03 -7.47 81.26 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.752 -178.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.7 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 73.8 mt -74.53 173.83 9.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.606 0.717 . . . . 0.0 111.596 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.3 p -119.05 166.01 13.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.582 178.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.67 -39.67 3.73 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.55 ' HA ' HD12 ' A' ' 5' ' ' ILE . 1.4 m -84.14 -54.07 5.08 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 121.961 0.104 . . . . 0.0 111.19 -179.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.03 -8.79 5.8 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.648 0.261 . . . . 0.0 111.113 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.808 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.5 tpt -85.91 -47.96 9.16 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.658 HG21 HD12 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -75.63 -30.92 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.995 0 CA-C-N 113.003 -1.908 . . . . 0.0 113.283 -177.726 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.448 ' HB2' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -69.97 -49.83 47.84 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.263 1.03 . . . . 0.0 109.297 177.629 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.428 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -58.34 -43.13 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.082 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.727 ' HB1' ' HB2' ' A' ' 33' ' ' ALA . . . -46.23 -41.9 13.52 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.563 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.672 HD21 ' HB2' ' A' ' 33' ' ' ALA . 8.5 mt -80.25 -28.62 38.42 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.157 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -70.62 -17.65 62.88 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -119.39 42.98 2.73 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.046 0.45 . . . . 0.0 110.903 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.638 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 69.6 t80 -55.95 172.63 0.18 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.645 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.429 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.155 0 C-N-CA 123.569 0.748 . . . . 0.0 111.961 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.608 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 120.93 0.395 . . . . 0.0 111.825 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 76.1 m95 -114.91 107.29 15.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.582 177.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -122.15 140.67 52.27 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.294 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.983 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -106.94 135.36 48.63 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.486 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.547 HG13 HD23 ' A' ' 7' ' ' LEU . 1.1 pt -151.65 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -95.12 89.37 5.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.564 HD13 HG22 ' B' ' 30' ' ' ILE . 1.6 mm? -129.24 100.94 5.78 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.491 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 12.7 p -69.67 -171.55 0.4 Allowed 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 122.028 0.918 . . . . 0.0 112.651 -177.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.31 -39.16 82.16 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.209 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.623 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 31.2 mt-30 -75.63 42.19 0.22 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.679 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.652 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 1.3 t -169.3 -31.87 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.483 ' CD2' HD21 ' B' ' 3' ' ' LEU . 16.7 mt -82.77 -43.08 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 177.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.9 -29.19 18.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.554 -1.657 . . . . 0.0 110.015 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.652 ' HB2' ' N ' ' A' ' 11' ' ' THR . 14.4 t70 -46.46 -13.58 0.02 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.709 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.857 ' HB2' ' HG3' ' A' ' 18' ' ' MET . 0.0 OUTLIER -140.14 46.45 1.84 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 179.224 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 6.3 mt-10 -49.67 -28.61 6.13 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 178.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -71.8 -48.12 48.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.857 ' HG3' ' HB2' ' A' ' 15' ' ' LEU . 16.0 mtm -59.08 -28.75 66.77 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.698 0.285 . . . . 0.0 111.331 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.728 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -98.79 -60.32 1.56 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.0 mtp85 . . . . . 0 CA--C 1.517 -0.311 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.728 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 82.9 mt . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 121.686 0.755 . . . . 0.0 111.512 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.463 ' O ' ' HB3' ' A' ' 29' ' ' MET . 52.2 p -117.43 165.47 13.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.025 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 mttm -47.7 -37.88 13.99 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.548 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.2 m -85.55 -50.81 6.94 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.16 -11.32 8.56 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.939 0.149 . . . . 0.0 111.055 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.741 ' C ' ' SD ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -84.27 -42.31 15.99 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.029 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.601 ' HA ' HD23 ' B' ' 34' ' ' LEU . 0.3 OUTLIER -77.28 -39.63 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.254 0 CA-C-N 112.901 -1.954 . . . . 0.0 113.269 -176.974 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.432 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -58.01 -46.2 85.65 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.325 1.059 . . . . 0.0 108.337 176.914 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.432 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -58.81 -43.48 88.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.062 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.689 ' CB ' HD21 ' B' ' 34' ' ' LEU . . . -60.46 -38.13 83.21 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.796 178.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.707 HD23 ' CB ' ' B' ' 33' ' ' ALA . 16.7 mt -70.3 -26.68 63.9 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.181 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.501 ' HG2' ' CE1' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -78.74 -30.19 45.67 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.129 -178.441 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.501 ' CE1' ' HG2' ' A' ' 35' ' ' GLN . 1.9 m80 -120.1 32.74 5.9 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.543 0.61 . . . . 0.0 111.375 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.561 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -83.26 132.21 35.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 122.476 -0.14 . . . . 0.0 110.657 179.326 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.548 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.483 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.491 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -78.81 116.63 19.27 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.483 HD21 ' CD2' ' A' ' 12' ' ' LEU . 1.7 tp -138.44 148.96 44.99 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.241 -178.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.983 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -107.04 134.93 49.44 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.399 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.574 ' CD1' HG21 ' A' ' 30' ' ' ILE . 4.3 pt -136.83 170.46 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.548 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 73.2 t-105 -97.11 102.33 14.08 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.562 ' CD2' HG13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -131.81 113.16 13.16 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.662 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.608 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 15.7 p -76.18 -173.9 2.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 112.025 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -48.52 -62.12 1.66 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.352 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -50.85 -28.89 10.43 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.574 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 69.3 p -88.01 -32.63 18.72 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' B' ' 8' ' ' SER . 67.9 mt -68.64 -40.45 80.29 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 177.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.85 -42.72 98.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 113.538 -1.664 . . . . 0.0 107.771 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.642 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -55.51 -46.74 76.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.092 178.589 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.614 HD21 HD11 ' A' ' 34' ' ' LEU . 15.0 mt -73.24 25.89 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 43.5 mt-10 -111.49 -56.59 2.36 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.68 -29.57 61.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.814 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 21.4 mtm -82.99 -22.35 33.69 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.772 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.701 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.73 -69.06 0.78 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.558 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.4 mtp85 -55.53 -64.24 0.91 Allowed 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.33 -32.44 17.18 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.192 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.537 ' HB2' ' O ' ' B' ' 18' ' ' MET . 3.8 mm-40 -89.68 -4.92 57.52 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.403 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.26 -11.02 61.83 Favored Glycine 0 C--N 1.34 0.768 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.953 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.701 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 74.8 mt -72.07 172.75 9.53 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.743 0.782 . . . . 0.0 111.685 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 89.8 p -119.87 164.28 16.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.253 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -43.55 -36.05 1.93 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.446 ' HA ' HD11 ' A' ' 5' ' ' ILE . 1.4 m -83.51 -56.48 3.72 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 122.221 0.208 . . . . 0.0 111.363 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.471 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.3 mt-10 -62.48 -8.56 6.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.495 178.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.814 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.3 tpt -86.0 -48.59 8.53 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.564 HG22 HD13 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -73.08 -35.12 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.044 0 CA-C-N 112.966 -1.925 . . . . 0.0 112.976 -178.051 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.456 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -66.55 -49.41 66.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 122.021 0.915 . . . . 0.0 109.155 177.503 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -57.3 -42.33 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 113.393 -1.73 . . . . 0.0 111.932 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.707 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -48.86 -39.68 26.65 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.429 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.689 HD21 ' CB ' ' A' ' 33' ' ' ALA . 9.2 mt -76.65 -35.83 57.73 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.196 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -11.12 60.46 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.432 ' HD1' HG11 ' B' ' 32' ' ' VAL . 43.2 m80 -106.87 -50.53 3.09 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.947 177.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.615 ' CD2' ' SD ' ' A' ' 18' ' ' MET . 12.0 t80 -44.12 144.58 0.92 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.264 0.352 . . . . 0.0 110.9 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.472 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.012 -0.995 . . . . 0.0 112.14 178.172 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 120.933 0.397 . . . . 0.0 111.881 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -89.02 122.83 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.044 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 3.2 mm? -130.08 153.8 48.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.896 -178.586 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.985 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -127.76 129.72 47.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.409 178.898 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.573 HG13 HD22 ' A' ' 7' ' ' LEU . 1.3 pt -148.11 -179.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.694 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.406 ' O ' ' HB3' ' B' ' 27' ' ' SER . 71.7 t-105 -95.06 91.32 6.29 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -177.264 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.573 HD22 HG13 ' A' ' 5' ' ' ILE . 1.8 mm? -127.46 104.05 7.69 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.451 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.656 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 8.4 t -75.5 -137.4 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 120.557 0.218 . . . . 0.0 110.916 -178.789 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -84.27 -155.76 0.2 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.963 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 36.01 43.11 0.19 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.505 0.722 . . . . 0.0 112.675 178.885 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.719 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -173.03 -45.38 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.725 178.681 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.491 HD22 HD23 ' B' ' 3' ' ' LEU . 18.1 mt -78.37 -40.74 35.42 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 175.981 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -38.84 26.91 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 113.187 -1.824 . . . . 0.0 108.315 177.606 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.719 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -48.97 -26.47 2.54 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.009 -1.451 . . . . 0.0 110.898 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.853 ' HG ' ' SD ' ' A' ' 29' ' ' MET . 0.4 OUTLIER -82.13 24.29 0.66 Allowed 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.475 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -66.14 -40.3 90.52 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 122.249 -0.282 . . . . 0.0 110.259 178.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -105.78 -13.68 15.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.789 ' HE1' ' HB3' ' B' ' 34' ' ' LEU . 0.1 OUTLIER -106.49 5.17 29.03 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 -179.015 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -98.76 -20.95 16.62 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 178.139 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.4 mtp-105 . . . . . 0 C--N 1.319 -0.741 0 O-C-N 121.62 -0.675 . . . . 0.0 110.112 -179.332 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.566 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 0.6 OUTLIER . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 122.358 1.075 . . . . 0.0 113.483 . . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -58.66 158.04 8.45 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.833 177.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.14 -40.76 5.21 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.231 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.9 m -77.77 -49.67 13.91 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.482 0.182 . . . . 0.0 111.277 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.566 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 9.5 mt-10 -55.96 -33.58 64.91 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.353 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.853 ' SD ' ' HG ' ' A' ' 15' ' ' LEU . 5.4 tpt -59.95 -51.91 67.67 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 123.18 1.466 . . . . 0.0 108.848 177.686 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.614 HG21 HD11 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -69.39 -29.81 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.587 0 CA-C-N 112.938 -1.937 . . . . 0.0 113.974 -177.265 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.416 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -70.44 -49.46 48.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.198 0.999 . . . . 0.0 108.882 176.706 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.527 HG23 HD13 ' A' ' 24' ' ' LEU . 1.4 t -56.33 -42.26 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.307 0 CA-C-N 113.093 -1.867 . . . . 0.0 111.434 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.72 ' CB ' HD22 ' B' ' 34' ' ' LEU . . . -48.44 -43.33 34.29 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.106 179.169 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.606 HD21 ' CB ' ' B' ' 33' ' ' ALA . 11.7 mt -70.73 -29.7 66.02 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.943 -178.141 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -76.92 -23.27 52.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.457 ' HD1' HG12 ' A' ' 32' ' ' VAL . 37.0 m80 -118.87 7.83 11.61 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 178.816 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.678 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.4 OUTLIER -61.96 138.05 58.32 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.168 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.445 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 117.883 -1.056 . . . . 0.0 112.334 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.656 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 2.1 ttt85 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -72.45 125.07 26.5 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.491 HD23 HD22 ' A' ' 12' ' ' LEU . 2.4 tp -126.37 141.24 51.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.732 -178.479 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.985 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -119.82 131.8 55.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.343 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.641 HD13 HD21 ' B' ' 7' ' ' LEU . 1.2 pp -157.19 173.05 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 121.05 0.452 . . . . 0.0 112.142 -178.434 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.8 t-105 -88.61 109.52 20.16 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.641 HD21 HD13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -130.91 122.02 26.22 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.085 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 33.7 t -78.03 -126.57 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -178.68 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.514 ' O ' ' HB3' ' B' ' 13' ' ' GLU . 12.4 t70 -105.06 -44.05 4.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.195 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.42 39.82 0.1 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.118 0.485 . . . . 0.0 111.618 -179.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.652 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 5.1 t -159.5 -41.34 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 179.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.516 ' CD2' ' HB2' ' B' ' 7' ' ' LEU . 50.3 mt -72.96 -41.86 63.99 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 176.729 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' B' ' 9' ' ' ASP . 0.1 OUTLIER -73.37 -38.29 65.74 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.196 -1.82 . . . . 0.0 107.365 176.793 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.652 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.2 t70 -47.74 -36.89 12.18 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.743 -1.571 . . . . 0.0 110.45 179.066 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.699 HD21 ' SD ' ' B' ' 29' ' ' MET . 45.7 mt -68.71 -10.92 59.23 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -179.592 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.35 -59.62 4.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.662 0.268 . . . . 0.0 110.927 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.57 -19.04 64.45 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.91 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.644 ' SD ' ' HD2' ' A' ' 37' ' ' TYR . 39.1 mtm -89.98 -77.01 0.41 Allowed 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.247 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.502 ' HA ' ' OE2' ' B' ' 22' ' ' GLU . . . -37.09 -41.52 0.37 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.138 0.575 . . . . 0.0 112.324 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -68.91 -71.02 0.24 Allowed 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.847 0.356 . . . . 0.0 111.497 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -29.81 45.79 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.08 179.326 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.613 ' HG3' ' HG ' ' B' ' 24' ' ' LEU . 3.9 pt-20 -83.71 -15.72 47.62 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.482 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.52 12.02 84.69 Favored Glycine 0 C--N 1.344 1.008 0 C-N-CA 121.214 -0.517 . . . . 0.0 114.011 178.416 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.613 ' HG ' ' HG3' ' B' ' 22' ' ' GLU . 65.1 mt -102.35 175.18 5.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.553 0.692 . . . . 0.0 111.668 -179.481 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 68.5 p -106.3 164.56 11.92 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.904 -1.043 . . . . 0.0 109.749 178.502 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.05 -39.04 1.12 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.352 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.522 ' HA ' HD11 ' A' ' 5' ' ' ILE . 1.2 m -81.15 -59.44 2.65 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 122.028 0.131 . . . . 0.0 111.3 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.476 ' HB3' HD23 ' B' ' 24' ' ' LEU . 2.3 mm-40 -57.76 -14.87 6.5 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.726 0.298 . . . . 0.0 110.922 179.036 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.699 ' SD ' HD21 ' B' ' 15' ' ' LEU . 1.7 tpt -78.41 -46.28 20.26 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 122.73 1.252 . . . . 0.0 107.996 177.743 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.628 HG12 HD13 ' B' ' 15' ' ' LEU . 0.4 OUTLIER -75.45 -29.7 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.109 0 CA-C-N 112.918 -1.946 . . . . 0.0 113.66 -177.605 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.458 ' HB2' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -70.26 -49.99 44.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.325 1.059 . . . . 0.0 109.009 177.329 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.476 HG23 HD13 ' B' ' 24' ' ' LEU . 1.9 t -56.71 -43.73 79.92 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 CA-C-N 112.958 -1.928 . . . . 0.0 110.967 -179.378 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.681 ' HB1' ' HB3' ' A' ' 33' ' ' ALA . . . -45.54 -39.34 7.34 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.341 179.072 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.789 ' HB3' ' HE1' ' A' ' 18' ' ' MET . 8.8 mt -75.97 -32.25 59.4 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.167 -177.938 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -79.92 -11.41 59.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -125.49 36.96 4.46 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.255 0.55 . . . . 0.0 111.05 177.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.7 ' HD1' ' N ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -58.37 130.08 45.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.362 178.86 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.703 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 7.1 mmpt? . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.58 176.051 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.733 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.803 0.335 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . 0.438 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.2 m95 -79.01 166.99 21.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.473 HD23 HD23 ' B' ' 12' ' ' LEU . 2.2 tp -176.76 145.49 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.099 -179.49 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -102.27 140.42 36.58 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.616 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.653 ' CD1' HG23 ' B' ' 30' ' ' ILE . 4.4 pt -148.47 175.46 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.268 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.663 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 75.4 t-105 -101.15 105.75 16.93 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.88 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.515 HD13 ' CG2' ' B' ' 30' ' ' ILE . 0.6 OUTLIER -127.2 120.28 28.4 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.728 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 t -82.36 -129.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -178.806 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.418 ' C ' ' H ' ' A' ' 11' ' ' THR . 17.8 t70 -102.77 -40.96 6.35 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.536 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.89 41.69 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.232 0.539 . . . . 0.0 111.522 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.799 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.0 t -164.41 -44.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.347 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.9 -40.37 96.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.407 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -64.32 -42.13 96.46 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.429 -1.714 . . . . 0.0 108.132 176.403 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.799 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.3 OUTLIER -51.38 -41.33 60.61 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.356 178.244 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.694 ' HB3' ' HG2' ' A' ' 29' ' ' MET . 24.6 mt -83.96 32.72 0.48 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.98 179.789 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -107.57 -69.35 0.85 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? -76.99 -25.69 53.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.405 179.079 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.557 ' HE3' ' HB3' ' B' ' 34' ' ' LEU . 0.9 OUTLIER -94.52 8.02 43.6 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.54 179.796 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.516 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -100.29 -17.97 17.04 Favored 'General case' 0 C--O 1.214 -0.785 0 C-N-CA 122.954 0.502 . . . . 0.0 112.199 178.894 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.814 0 O-C-N 121.592 -0.693 . . . . 0.0 109.866 -179.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.548 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 122.606 1.193 . . . . 0.0 114.147 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.06 154.11 13.37 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.516 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -42.69 8.84 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-O 120.438 0.161 . . . . 0.0 111.209 -179.685 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.622 ' HB3' ' CB ' ' B' ' 6' ' ' TRP . 5.9 m -75.65 -44.63 41.58 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.919 179.26 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.548 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.9 OUTLIER -62.4 -37.32 85.31 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.509 179.513 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.721 ' HE2' ' CG2' ' A' ' 32' ' ' VAL . 3.3 tpt -57.99 -43.52 86.62 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 124.125 1.917 . . . . 0.0 108.36 177.058 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.692 HG12 ' CD1' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -68.61 -16.3 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.911 0 CA-C-N 112.583 -2.099 . . . . 0.0 112.949 -177.778 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -86.83 -45.13 11.17 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.901 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.721 ' CG2' ' HE2' ' A' ' 29' ' ' MET . 0.0 OUTLIER -59.0 -31.4 45.54 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.635 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.983 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -38.08 -46.84 1.06 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.319 177.951 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.64 HD11 ' HB ' ' B' ' 11' ' ' THR . 8.1 mt -82.68 -26.56 31.98 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.653 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -87.84 -13.75 41.29 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -179.789 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.983 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -117.9 4.09 12.18 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 179.699 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.681 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.8 t80 -76.56 146.38 38.39 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.8 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.471 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.202 179.442 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.433 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -90.7 105.1 17.59 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.732 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.438 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 1.9 tp -125.26 145.64 49.9 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.251 -177.77 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -103.27 136.91 42.17 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 177.627 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.661 HD13 HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -149.53 -175.0 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.015 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.622 ' CB ' ' HB3' ' A' ' 27' ' ' SER . 64.8 t-105 -92.62 91.0 7.35 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.396 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.566 ' CD1' ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -125.2 95.08 4.36 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.601 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.733 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 51.2 p -64.73 177.82 0.88 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 121.761 0.791 . . . . 0.0 111.853 -178.377 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -54.19 -52.65 60.55 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.649 -179.744 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -55.68 -26.88 47.11 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -179.169 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.64 ' HB ' HD11 ' A' ' 34' ' ' LEU . 37.1 p -82.97 -30.29 28.38 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.286 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.473 HD23 HD23 ' A' ' 3' ' ' LEU . 30.0 mt -73.77 -39.33 64.26 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 178.619 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.8 mt-10 -60.15 -41.29 92.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 113.719 -1.582 . . . . 0.0 107.612 175.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.502 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -53.21 -39.91 64.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.192 -1.367 . . . . 0.0 110.537 178.603 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.66 HD23 ' SD ' ' B' ' 29' ' ' MET . 30.9 mt -77.75 28.4 0.17 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.503 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -101.01 -49.58 4.07 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.657 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.503 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 57.0 mttm -84.61 -20.81 30.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.58 179.25 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.854 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.6 mtm -91.93 -21.04 20.79 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.612 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.687 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -102.66 -62.25 1.3 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.253 179.714 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 4.8 mtp-105 -62.21 -64.94 0.77 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.962 0.41 . . . . 0.0 111.691 -179.487 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -33.4 21.83 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.286 179.78 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.516 ' HB2' ' O ' ' B' ' 18' ' ' MET . 22.3 mm-40 -85.77 -11.57 53.19 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.292 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.1 -6.02 84.08 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.791 -178.428 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.687 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.1 mt -74.08 174.69 8.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.57 0.7 . . . . 0.0 111.529 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 23.1 p -116.95 168.88 9.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.665 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -47.52 -41.17 20.45 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.322 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.663 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 80.8 p -84.62 -49.74 8.29 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.889 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.481 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.8 mm-40 -64.35 -7.95 11.41 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.628 0.251 . . . . 0.0 110.77 178.805 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.854 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.7 tpt -85.88 -48.03 9.12 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 122.741 1.258 . . . . 0.0 107.804 177.504 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.653 HG23 ' CD1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -75.89 -38.0 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.041 0 CA-C-N 112.907 -1.951 . . . . 0.0 113.189 -177.744 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.403 HD21 ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -63.69 -46.91 83.38 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.324 1.059 . . . . 0.0 109.092 177.967 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.481 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -61.62 -43.41 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.627 -179.104 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.681 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -47.89 -30.5 4.19 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.932 179.797 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.648 HD21 ' HB2' ' A' ' 33' ' ' ALA . 12.1 mt -90.44 -30.48 17.32 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -177.145 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -71.65 -17.33 62.26 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -110.99 39.06 2.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.559 ' HD2' ' CE1' ' A' ' 36' ' ' HIS . 51.0 t80 -86.08 160.02 19.4 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.792 -178.61 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.2 mppt? . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.576 178.351 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.482 ' CB ' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.934 0.397 . . . . 0.0 111.807 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -87.23 165.07 15.96 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.697 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.617 HD22 HD21 ' B' ' 12' ' ' LEU . 2.6 tp -167.94 147.12 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.631 -179.411 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -125.26 135.77 52.87 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.969 178.97 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.621 HD12 ' CG2' ' B' ' 30' ' ' ILE . 0.3 OUTLIER -151.22 -174.84 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -178.724 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.718 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 67.5 t-105 -97.03 95.57 7.89 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.817 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.474 ' O ' ' HB2' ' B' ' 1' ' ' ARG . 1.2 mm? -126.78 103.72 7.68 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.55 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.753 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.2 OUTLIER -95.84 -171.38 2.33 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.636 0.732 . . . . 0.0 112.661 -177.442 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -43.3 -56.44 3.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.227 -1.351 . . . . 0.0 112.367 -178.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -50.03 -28.51 7.14 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.159 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.652 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 19.8 p -97.39 -28.49 13.99 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.406 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 8' ' ' SER . 21.4 mt -75.49 -40.94 56.62 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 178.835 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.523 ' O ' ' HB3' ' A' ' 16' ' ' GLU . 2.9 mt-10 -65.79 -40.31 91.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 113.766 -1.561 . . . . 0.0 108.076 176.103 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.652 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -47.55 -45.29 26.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.59 179.039 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.824 ' HG ' ' HG2' ' A' ' 29' ' ' MET . 3.5 mm? -77.43 16.73 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -178.542 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.546 ' CG ' ' HG2' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -74.12 -46.9 39.73 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.632 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.546 ' HG2' ' CG ' ' A' ' 16' ' ' GLU . 1.5 mmtm -96.88 1.95 51.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.612 179.029 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.5 ' HB2' HD11 ' A' ' 15' ' ' LEU . 5.0 mtm -108.06 -74.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.983 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.795 ' HA ' HD22 ' A' ' 24' ' ' LEU . . . -53.46 -50.7 64.74 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.572 0.349 . . . . 0.0 111.827 -178.911 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.51 -0.592 0 CA-C-O 121.14 0.495 . . . . 0.0 110.481 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.795 HD22 ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.378 0 CA-C-O 121.184 0.516 . . . . 0.0 111.959 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.8 p -96.82 164.32 12.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.446 178.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -46.2 -32.14 2.84 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.763 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.618 ' HA ' HD11 ' B' ' 5' ' ' ILE . 6.7 p -77.2 -50.55 12.7 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.853 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.489 ' HB2' ' HG ' ' A' ' 24' ' ' LEU . 10.8 mt-10 -55.74 -24.43 35.14 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.851 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.824 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -78.12 -42.33 32.28 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 121.925 0.869 . . . . 0.0 109.029 178.658 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.726 HG21 HD12 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -78.25 -23.15 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.477 0 CA-C-N 114.195 -1.366 . . . . 0.0 113.359 -176.699 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -72.87 -53.34 11.67 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.749 0.785 . . . . 0.0 109.13 176.288 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.524 HG22 ' HD1' ' A' ' 36' ' ' HIS . 12.7 p -61.99 -30.89 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.962 0 CA-C-N 114.128 -1.396 . . . . 0.0 112.594 -177.673 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.728 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -42.37 -37.69 1.63 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.451 177.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.641 HD23 ' CB ' ' B' ' 33' ' ' ALA . 8.4 mt -87.89 -29.37 20.92 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.837 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -69.72 -59.46 2.93 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -177.523 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.772 ' NE2' ' HB2' ' B' ' 37' ' ' TYR . 9.7 p-80 -56.93 -36.16 69.91 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 119.158 0.89 . . . . 0.0 111.973 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.739 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 10.4 t80 -42.17 145.73 0.35 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 -177.499 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.249 1.039 0 C-N-CA 124.279 1.031 . . . . 0.0 112.769 178.299 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.753 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 120.992 0.425 . . . . 0.0 111.829 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -108.93 116.19 31.52 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 177.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.491 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.12 144.66 51.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.388 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.02 133.35 56.11 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.502 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.618 HD11 ' HA ' ' A' ' 27' ' ' SER . 0.9 OUTLIER -149.59 -177.71 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.468 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -91.17 87.64 6.61 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -177.094 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.726 HD12 HG21 ' A' ' 30' ' ' ILE . 1.9 mm? -119.81 101.43 7.88 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.814 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.482 ' HA ' ' CB ' ' A' ' 1' ' ' ARG . 48.0 t -67.05 -117.69 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.67 -178.188 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.24 -147.35 0.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.266 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . 0.443 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.5 tm0? 34.36 44.4 0.1 Allowed 'General case' 0 C--N 1.346 0.43 0 C-N-CA 123.847 0.859 . . . . 0.0 113.202 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.656 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.0 OUTLIER -177.48 -46.5 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.436 178.971 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.617 HD21 HD22 ' A' ' 3' ' ' LEU . 27.1 mt -73.47 -40.65 63.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.789 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -76.95 -37.46 55.23 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 113.297 -1.774 . . . . 0.0 108.161 176.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.656 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -52.32 -20.07 2.5 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.029 178.322 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.911 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.1 OUTLIER -71.63 43.96 0.09 Allowed 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 125.172 1.389 . . . . 0.0 112.21 179.323 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -86.73 -58.72 2.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.938 179.537 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -98.02 22.57 9.19 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.261 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.776 ' HB2' HD11 ' B' ' 15' ' ' LEU . 0.5 OUTLIER -103.15 -84.68 0.46 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.663 179.75 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.666 ' HB2' HD13 ' B' ' 15' ' ' LEU . . . -49.0 -41.75 35.51 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.018 0.527 . . . . 0.0 111.185 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 mtt-85 -64.35 -67.77 0.41 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.965 0.412 . . . . 0.0 111.078 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -32.65 44.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.969 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' B' ' 18' ' ' MET . 37.8 mt-10 -82.66 -17.15 45.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.945 179.747 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.09 9.41 86.97 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -177.301 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 95.3 mt -88.62 171.48 10.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.555 0.742 . . . . 0.0 111.769 -179.445 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 87.5 p -110.53 163.34 13.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.074 177.578 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -43.25 -38.55 2.62 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.214 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.718 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 69.5 m -83.2 -52.14 6.85 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.631 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.46 ' HB3' HD21 ' B' ' 24' ' ' LEU . 3.9 mm-40 -65.44 -11.58 44.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.132 0.491 . . . . 0.0 110.562 178.916 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.911 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.9 tpt -81.59 -45.25 16.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 177.306 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.621 ' CG2' HD12 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -74.52 -25.79 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.689 0 CA-C-N 112.58 -2.1 . . . . 0.0 112.872 -178.13 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.538 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.45 -50.37 69.99 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.842 0.829 . . . . 0.0 109.282 177.508 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.538 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 14.0 p -74.44 -31.26 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.788 -1.551 . . . . 0.0 113.572 -176.868 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.806 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -53.96 -38.41 64.95 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 122.121 0.962 . . . . 0.0 109.235 177.469 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.637 HD23 HD23 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -77.77 -41.29 38.01 Favored 'General case' 0 N--CA 1.399 -3.009 0 CA-C-N 113.878 -1.51 . . . . 0.0 110.738 -178.768 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . 0.565 ' N ' ' CD1' ' B' ' 34' ' ' LEU . 5.5 mt-30 -57.12 -62.19 1.93 Allowed 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.186 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.806 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.9 p-80 -53.33 -32.51 49.37 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.854 1.206 . . . . 0.0 110.778 179.695 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.772 ' HB2' ' NE2' ' A' ' 36' ' ' HIS . 62.8 t80 -61.94 160.01 13.08 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.306 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.59 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 10.5 mmmt . . . . . 0 C--O 1.248 0.987 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.85 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.591 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.018 0.437 . . . . 0.0 111.828 . . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -114.94 114.6 25.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.132 177.691 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -131.98 154.98 48.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.421 -178.866 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -124.38 131.55 53.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.788 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.663 HD12 ' HA ' ' B' ' 27' ' ' SER . 4.1 pt -146.02 176.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.364 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.0 t-105 -97.88 97.76 9.23 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.155 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.648 HD11 HG21 ' B' ' 30' ' ' ILE . 1.5 mm? -121.68 112.16 18.07 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 177.08 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.452 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.4 p -80.16 -145.94 0.05 OUTLIER 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 120.786 0.327 . . . . 0.0 111.411 -178.647 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -75.87 -159.82 0.12 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.953 -179.087 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.421 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 tt0 36.11 44.87 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.487 0.715 . . . . 0.0 112.62 179.048 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.713 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 12.4 t -176.01 -43.98 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.087 179.167 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 8' ' ' SER . 27.8 mt -71.03 -42.28 69.74 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 175.943 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -68.15 -39.5 82.63 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 113.286 -1.779 . . . . 0.0 107.521 176.017 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.713 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.1 t70 -50.21 -36.33 30.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.274 178.803 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.753 HD21 ' SD ' ' A' ' 29' ' ' MET . 51.3 mt -66.82 6.08 0.54 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -69.16 -61.93 1.59 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.228 -0.295 . . . . 0.0 110.687 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -77.92 -11.3 59.88 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.87 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 9.6 mtm -93.95 -29.57 15.19 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.261 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.758 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -103.98 -64.49 1.1 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.917 -0.129 . . . . 0.0 111.214 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 . . . . . 0 CA--C 1.515 -0.382 0 CA-C-O 121.149 0.5 . . . . 0.0 111.791 -179.61 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.758 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.7 mt . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 121.561 0.696 . . . . 0.0 111.482 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 96.0 p -118.32 163.11 17.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.59 -1.187 . . . . 0.0 109.674 178.622 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.436 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -39.43 -37.84 0.5 Allowed 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.532 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.603 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 3.4 m -83.98 -56.88 3.44 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.425 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HB3' HD21 ' A' ' 24' ' ' LEU . 3.1 mt-10 -61.87 -9.66 7.37 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.675 0.274 . . . . 0.0 110.437 179.017 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.87 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.6 tpt -85.64 -48.34 8.97 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 122.742 1.258 . . . . 0.0 108.057 178.083 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.654 HG23 ' CD1' ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.03 -39.87 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 112.887 -1.96 . . . . 0.0 112.873 -177.796 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.71 -46.25 91.11 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 122.215 1.007 . . . . 0.0 108.647 177.462 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.1 t -59.36 -43.11 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 CA-C-N 113.155 -1.838 . . . . 0.0 110.509 179.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.615 ' HB1' ' HB1' ' B' ' 33' ' ' ALA . . . -55.34 -33.33 63.27 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.543 178.466 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.657 HD21 ' CB ' ' B' ' 33' ' ' ALA . 14.2 mt -77.68 -30.15 51.81 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.044 -178.747 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -80.1 -17.04 53.65 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.244 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -110.59 15.15 22.22 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 178.735 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.48 -166.29 0.1 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 122.942 0.497 . . . . 0.0 109.956 178.823 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.554 ' HD3' ' N ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.489 1.516 . . . . 0.0 112.606 -178.091 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.375 0.131 . . . . 0.0 111.291 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -84.79 121.25 27.43 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.786 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.3 mm? -137.36 153.19 50.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 -179.549 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -115.88 130.57 56.89 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.572 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.654 ' CD1' HG23 ' A' ' 30' ' ' ILE . 4.4 pt -142.4 172.63 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.661 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.603 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 73.2 t-105 -99.6 104.61 16.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -177.446 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 0.6 OUTLIER -132.39 114.66 14.61 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.554 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.591 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 10.4 p -77.26 -173.55 2.88 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.636 0.732 . . . . 0.0 112.702 -177.954 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -48.29 -62.93 1.23 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.336 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.69 -28.71 9.55 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.551 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.596 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 74.1 p -86.33 -32.2 21.14 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.713 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' B' ' 8' ' ' SER . 52.2 mt -71.33 -39.91 71.08 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 177.916 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -62.44 -41.67 98.9 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 113.469 -1.696 . . . . 0.0 107.793 175.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.636 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.7 OUTLIER -54.48 -47.54 72.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.205 178.876 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.632 HD21 ' CG ' ' B' ' 29' ' ' MET . 15.2 mt -74.75 27.65 0.09 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.401 ' H ' ' C ' ' B' ' 14' ' ' ASP . 3.4 mm-40 -109.15 -55.3 2.43 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.87 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.83 -36.95 41.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.498 178.581 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.704 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 13.6 mtm -73.23 -16.82 61.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.455 178.58 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.807 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.93 -69.17 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.44 -179.485 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -69.41 0.21 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.966 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.46 -32.08 7.26 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.834 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.704 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 2.9 mt-10 -83.86 -24.36 30.9 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.386 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . 0.431 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 99.18 64.04 0.84 Allowed Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.224 -0.988 . . . . 0.0 113.916 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.807 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -179.11 -177.62 0.48 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 177.77 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 25' ' ' SER . . . . . 0.542 ' N ' HD22 ' B' ' 24' ' ' LEU . 3.5 t -114.94 174.78 5.8 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.667 -179.149 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.45 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 0.0 OUTLIER -43.84 -38.92 3.56 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.083 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.663 ' HA ' HD12 ' A' ' 5' ' ' ILE . 3.2 p -80.3 -56.0 4.51 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 117.523 0.147 . . . . 0.0 111.351 -179.552 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.678 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.4 mm-40 -62.93 -11.8 21.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.555 0.217 . . . . 0.0 110.534 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.632 ' CG ' HD21 ' B' ' 15' ' ' LEU . 2.1 tpt -81.97 -47.6 12.5 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 122.699 1.238 . . . . 0.0 107.736 177.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.648 HG21 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -74.31 -37.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.11 0 CA-C-N 112.894 -1.957 . . . . 0.0 112.944 -177.846 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -61.57 -48.38 81.23 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 122.26 1.029 . . . . 0.0 108.543 176.9 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -58.04 -41.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 CA-C-N 113.015 -1.902 . . . . 0.0 111.561 -179.436 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.657 ' CB ' HD21 ' A' ' 34' ' ' LEU . . . -53.16 -37.61 62.03 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.902 179.194 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.567 HD22 ' CB ' ' A' ' 33' ' ' ALA . 15.4 mt -75.56 -31.97 60.23 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.774 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -77.82 -17.79 57.05 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.516 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -96.23 -35.28 11.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 121.259 -0.176 . . . . 0.0 110.99 177.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.54 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 13.4 t80 -40.89 143.09 0.4 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.651 0.38 . . . . 0.0 111.091 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt . . . . . 0 C--O 1.251 1.139 0 C-N-CA 123.587 0.755 . . . . 0.0 112.299 179.035 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.68 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.5 mpt_? . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.917 0.389 . . . . 0.0 111.518 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 87.9 m95 -104.68 116.35 31.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.001 178.745 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -133.21 157.4 45.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.72 -179.57 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.991 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -113.88 138.41 50.34 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.783 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.558 ' CD1' ' HB2' ' A' ' 7' ' ' LEU . 2.3 pp -154.69 167.5 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.37 0.605 . . . . 0.0 112.351 -178.589 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.496 ' O ' ' HB3' ' B' ' 27' ' ' SER . 68.0 t-105 -79.02 88.69 4.78 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.374 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.583 ' HG ' HD23 ' A' ' 12' ' ' LEU . 29.9 tp -125.83 84.62 2.29 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.938 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.579 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 47.9 p -63.41 175.39 1.02 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 122.248 1.023 . . . . 0.0 113.631 -177.067 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.99 -44.46 78.61 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 113.186 -1.825 . . . . 0.0 112.709 -179.35 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -40.54 -37.59 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.748 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.761 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.4 t -109.29 -11.03 14.92 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -178.859 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.583 HD23 ' HG ' ' A' ' 7' ' ' LEU . 66.5 mt -70.05 -38.44 75.82 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 175.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.89 -40.79 98.61 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.164 -1.835 . . . . 0.0 107.952 176.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.761 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -53.14 -42.99 66.6 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.461 178.497 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.684 HD11 HG12 ' A' ' 30' ' ' ILE . 28.9 mt -75.86 19.71 0.2 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -99.27 -50.24 4.19 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.28 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -81.37 -33.63 32.24 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.712 178.528 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.515 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 25.0 mtm -67.65 -69.92 0.29 Allowed 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.092 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.757 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -37.27 -44.91 0.62 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.558 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.064 0.459 . . . . 0.0 111.309 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.757 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 121.354 0.597 . . . . 0.0 112.346 . . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.06 169.42 8.45 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.67 -40.2 4.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -179.069 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.748 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 23.9 m -78.08 -56.47 4.45 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.589 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mt-10 -60.54 -18.71 54.02 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.055 0.455 . . . . 0.0 109.838 178.762 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.632 ' HG2' ' HB3' ' A' ' 15' ' ' LEU . 3.2 tpt -71.53 -47.86 52.5 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 123.122 1.439 . . . . 0.0 107.916 177.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.684 HG12 HD11 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -69.61 -28.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.614 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.155 -178.484 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.427 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -67.08 -49.39 65.19 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.937 0.875 . . . . 0.0 108.946 177.052 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.427 ' HA ' ' NE2' ' A' ' 35' ' ' GLN . 0.9 OUTLIER -57.4 -42.42 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.95 -179.905 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.721 ' CB ' HD21 ' B' ' 34' ' ' LEU . . . -50.87 -39.84 54.95 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.038 178.976 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.582 HD12 HD23 ' B' ' 15' ' ' LEU . 13.5 mt -73.45 -28.98 62.25 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.474 -178.32 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.427 ' NE2' ' HA ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -78.93 -19.76 50.99 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.08 -179.503 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.425 ' HD1' HG13 ' A' ' 32' ' ' VAL . 73.3 m80 -104.61 -35.89 7.67 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 178.281 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.583 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.3 t80 -30.79 130.87 0.1 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.0 0.52 . . . . 0.0 112.135 -179.753 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.437 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 117.993 -1.003 . . . . 0.0 112.07 177.956 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.579 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.802 0.334 . . . . 0.0 111.523 . . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -74.78 145.64 42.77 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.322 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.552 HD22 HD22 ' A' ' 12' ' ' LEU . 1.7 tp -158.05 150.63 22.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.165 -178.85 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.991 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.3 m -111.02 140.68 45.35 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.643 HD13 ' CG2' ' A' ' 30' ' ' ILE . 3.7 pt -148.41 179.8 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.98 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.748 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.3 t-105 -99.96 101.41 12.5 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -177.187 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.514 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -133.47 113.1 12.12 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 177.172 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.68 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -89.84 -165.83 1.44 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.415 0.626 . . . . 0.0 112.302 -178.132 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -47.79 -65.4 0.57 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.774 -178.476 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -49.3 -25.38 2.35 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.532 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.649 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 30.2 p -94.65 -38.89 10.62 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.552 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' B' ' 8' ' ' SER . 74.6 mt -63.93 -40.83 97.36 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 178.412 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.33 -43.18 98.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 113.747 -1.57 . . . . 0.0 107.975 176.298 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.649 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.71 -45.28 70.39 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.332 178.751 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.663 HD21 ' SD ' ' B' ' 29' ' ' MET . 18.0 mt -72.72 28.36 0.06 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.343 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 6.2 mm-40 -109.55 -56.28 2.32 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.16 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 1.1 mttm -75.86 -25.53 56.27 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 178.698 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.824 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.0 mtm -87.04 -23.35 25.0 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.208 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.684 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.34 -67.63 0.85 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.519 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -54.07 -67.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 4.8 mmm180 -49.01 -32.31 9.05 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.383 179.717 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.4 mm-40 -88.94 -6.64 57.13 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.466 179.808 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.42 -8.07 69.78 Favored Glycine 0 C--N 1.338 0.687 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.814 -178.526 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.684 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.6 mt -74.12 170.91 14.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.668 0.747 . . . . 0.0 111.605 -179.901 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.6 m -118.62 162.7 17.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.37 178.281 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.527 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -40.55 -37.46 0.71 Allowed 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -179.077 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.496 ' HB3' ' O ' ' A' ' 6' ' ' TRP . 0.7 OUTLIER -82.55 -57.56 3.29 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 122.697 0.399 . . . . 0.0 111.689 -179.538 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.442 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.2 mt-10 -61.69 -10.87 9.59 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.34 178.899 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.824 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.5 tpt -83.71 -47.86 10.74 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.769 1.271 . . . . 0.0 107.836 177.955 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.558 HG12 HD13 ' B' ' 15' ' ' LEU . 0.5 OUTLIER -73.64 -33.25 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.09 0 CA-C-N 112.791 -2.004 . . . . 0.0 113.147 -177.906 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.449 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -70.13 -48.7 56.4 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.94 0.876 . . . . 0.0 109.338 177.394 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.449 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.2 t -56.22 -40.3 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-N 113.499 -1.682 . . . . 0.0 110.642 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.68 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . . . -53.63 -32.68 52.33 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.482 179.005 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.721 HD21 ' CB ' ' A' ' 33' ' ' ALA . 11.3 mt -82.36 -32.83 29.09 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.78 -177.825 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -80.54 -8.42 59.57 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -112.17 8.21 19.81 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.488 0.185 . . . . 0.0 111.327 177.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.507 ' CD2' ' HD2' ' B' ' 38' ' ' LYS . 3.3 t80 -66.3 -169.29 0.07 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.085 0.554 . . . . 0.0 109.6 178.592 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.507 ' HD2' ' CD2' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.363 1.465 . . . . 0.0 112.915 -178.408 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 120.815 0.34 . . . . 0.0 111.864 . . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -98.37 114.6 26.99 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.444 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 3.2 tp -122.25 142.39 50.51 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.266 -177.931 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.6 OUTLIER -123.76 128.77 50.05 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.663 178.217 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.573 HD12 ' CG2' ' B' ' 30' ' ' ILE . 1.1 pp -155.75 173.71 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -178.076 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -95.28 112.64 24.32 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -176.83 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.609 HD13 HG22 ' B' ' 30' ' ' ILE . 0.4 OUTLIER -129.52 122.65 29.65 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.519 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.8 p -80.31 -173.23 3.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.318 0.58 . . . . 0.0 110.412 -179.802 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.43 ' HA ' HD21 ' A' ' 12' ' ' LEU . 3.7 p-10 -61.93 -162.11 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.201 -178.645 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.449 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.54 40.43 0.12 Allowed 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.635 0.774 . . . . 0.0 112.805 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.717 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 2.0 t -179.78 -56.46 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.002 179.441 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.718 HD23 ' CD ' ' B' ' 1' ' ' ARG . 0.6 OUTLIER -62.61 -29.1 70.36 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 175.831 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.418 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 2.8 mm-40 -92.43 -37.5 12.52 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.609 -1.632 . . . . 0.0 108.692 177.201 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.717 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -45.34 -31.03 1.45 Allowed 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.718 179.472 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.692 HD12 HG12 ' A' ' 30' ' ' ILE . 43.8 mt -72.47 19.21 0.08 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 179.609 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -95.88 -48.6 5.66 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.217 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -84.63 -38.09 20.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.556 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.461 ' O ' ' N ' ' A' ' 20' ' ' ARG . 17.2 mtm -64.26 -72.69 0.14 Allowed 'General case' 0 C--N 1.341 0.239 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.427 179.466 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.556 ' HB1' ' O ' ' A' ' 15' ' ' LEU . . . -28.5 -32.17 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.888 1.368 . . . . 0.0 113.934 -178.602 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.481 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 3.7 mmm180 . . . . . 0 C--N 1.31 -1.14 0 C-N-CA 119.729 -0.789 . . . . 0.0 110.35 179.194 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.56 HD11 HG22 ' A' ' 32' ' ' VAL . 1.2 mp . . . . . 0 N--CA 1.454 -0.236 0 CA-C-O 122.319 1.057 . . . . 0.0 113.353 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -60.82 165.21 4.15 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 114.282 -1.326 . . . . 0.0 110.373 178.535 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -43.87 66.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.311 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 m -80.71 -46.92 14.75 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.283 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.566 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 2.5 mm-40 -57.36 -27.49 62.33 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.591 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.523 ' O ' ' CE ' ' A' ' 29' ' ' MET . 4.2 tpt -63.61 -48.3 77.88 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 122.925 1.345 . . . . 0.0 109.109 177.702 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.692 HG12 HD12 ' A' ' 15' ' ' LEU . 0.3 OUTLIER -77.94 -29.78 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.582 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.128 -176.282 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -71.75 -50.02 33.83 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.052 0.929 . . . . 0.0 109.459 177.785 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.566 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.3 t -57.85 -42.86 83.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.817 -179.488 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.722 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -50.51 -27.71 7.12 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.625 179.154 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.68 HD11 HD23 ' B' ' 15' ' ' LEU . 10.9 mt -91.42 -30.91 16.24 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.922 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -75.7 -14.24 60.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.076 0.398 . . . . 0.0 112.076 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -111.04 35.6 3.48 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.491 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.586 ' CD2' ' N ' ' A' ' 38' ' ' LYS . 67.3 t80 -74.31 162.22 29.11 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.341 -178.735 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.586 ' N ' ' CD2' ' A' ' 37' ' ' TYR . 6.8 mmmt . . . . . 0 C--O 1.251 1.136 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.086 177.794 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.718 ' CD ' HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 120.785 0.326 . . . . 0.0 111.878 . . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -89.56 122.46 32.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.834 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.506 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 mm? -133.61 151.07 51.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.958 0.409 . . . . 0.0 111.95 -178.605 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -123.78 124.25 42.28 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.257 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.557 HD13 HG22 ' A' ' 30' ' ' ILE . 3.8 pt -147.21 176.99 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.794 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 70.6 t-105 -96.9 101.82 13.48 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.268 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.574 HD13 HG21 ' A' ' 30' ' ' ILE . 0.7 OUTLIER -130.85 112.26 12.85 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.476 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.565 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 9.8 p -84.76 178.92 7.46 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.029 0.919 . . . . 0.0 113.028 -177.89 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -47.69 -49.15 28.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 113.321 -1.763 . . . . 0.0 112.781 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -43.46 -35.02 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.527 -178.846 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.729 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 3.9 t -112.28 -7.74 13.99 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -179.202 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' B' ' 8' ' ' SER . 73.8 mt -72.88 -38.96 66.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 175.762 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.54 -41.35 98.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.285 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.729 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -52.2 -43.05 64.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.622 178.794 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.76 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 16.5 mt -79.09 22.88 0.38 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.628 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -43.35 4.48 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -80.71 -46.91 14.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.301 0.24 . . . . 0.0 111.524 179.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.674 ' HG3' ' SD ' ' B' ' 29' ' ' MET . 0.4 OUTLIER -81.32 10.04 6.2 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.61 ' HB1' ' HB2' ' B' ' 29' ' ' MET . . . -111.04 -61.06 1.75 Allowed 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.542 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 29.9 mmm-85 -62.0 -63.51 1.23 Allowed 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.182 0.515 . . . . 0.0 111.505 179.191 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -34.56 35.35 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.844 179.534 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -80.48 -12.65 59.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.673 179.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.59 -12.91 68.69 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.76 -178.666 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.411 HD21 ' HB3' ' B' ' 28' ' ' GLU . 43.4 mt -74.26 175.3 7.72 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.907 0.86 . . . . 0.0 112.22 -179.793 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -118.33 173.29 6.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.166 178.139 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.56 -38.85 60.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 7.3 m -79.79 -52.66 7.64 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.539 0.209 . . . . 0.0 111.029 179.819 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.411 ' HB3' HD21 ' B' ' 24' ' ' LEU . 2.7 mm-40 -63.82 -13.52 45.25 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.262 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.76 ' HG2' ' HB3' ' B' ' 15' ' ' LEU . 1.2 tpt -80.84 -45.77 16.37 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 123.714 1.721 . . . . 0.0 107.176 177.129 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.635 HG12 ' CD1' ' B' ' 15' ' ' LEU . 0.5 OUTLIER -65.71 -17.91 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.772 0 CA-C-N 112.943 -1.935 . . . . 0.0 111.957 -179.099 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.411 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -80.34 -47.51 14.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.075 176.82 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.749 ' CG2' ' HE1' ' B' ' 29' ' ' MET . 0.1 OUTLIER -59.25 -30.94 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 CA-C-O 121.665 0.745 . . . . 0.0 108.996 178.549 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.995 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -37.42 -44.35 0.63 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 113.722 -1.581 . . . . 0.0 110.924 177.919 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.611 HD13 HD22 ' A' ' 15' ' ' LEU . 9.2 mt -83.78 -30.45 26.59 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.534 -179.392 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' B' ' 32' ' ' VAL . 13.2 mt-30 -82.89 -15.61 50.8 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.426 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.995 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 1.0 OUTLIER -118.3 6.06 11.89 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.974 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.722 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 1.0 OUTLIER -78.49 137.84 38.14 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.172 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.451 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 117.931 -1.033 . . . . 0.0 112.025 178.366 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.836 ' HD3' HD23 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 . . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -88.96 118.39 28.65 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.107 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 mm? -131.85 154.76 48.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.73 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -127.03 135.23 50.53 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 178.775 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.668 HD11 HD22 ' A' ' 7' ' ' LEU . 2.3 pp -151.12 171.86 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.898 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.589 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 73.2 t-105 -84.76 91.64 8.02 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.036 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.668 HD22 HD11 ' A' ' 5' ' ' ILE . 2.9 mp -131.45 98.68 4.59 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 177.038 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.795 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -74.07 -168.22 0.6 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.525 0.678 . . . . 0.0 112.127 -177.863 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -55.17 -54.39 43.88 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.478 -1.237 . . . . 0.0 113.078 -178.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -50.35 -22.58 1.89 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.461 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 15.7 p -96.72 -25.46 15.52 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.718 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 8' ' ' SER . 20.0 mt -78.8 -37.33 41.11 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 178.613 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.96 -41.29 78.04 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 174.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 18' ' ' MET . 0.1 OUTLIER -55.63 -47.44 76.59 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.683 177.421 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.765 ' HB3' ' HG2' ' A' ' 29' ' ' MET . 22.3 mt -81.32 31.56 0.34 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.829 179.657 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.412 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -113.78 -49.58 2.87 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.687 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.412 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 2.1 ptmm? -88.83 -28.8 20.16 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.613 0.365 . . . . 0.0 111.056 178.577 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.583 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 6.9 mtm -87.04 -8.17 57.38 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.567 178.743 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.497 ' HB1' ' O ' ' A' ' 15' ' ' LEU . . . -89.69 -18.99 25.37 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.063 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.314 -0.946 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.863 -179.485 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.571 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 . . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.66 163.33 3.32 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 113.727 -1.579 . . . . 0.0 110.593 178.692 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -51.13 -43.81 61.24 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.801 0.296 . . . . 0.0 111.801 -179.474 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -77.08 -39.59 49.19 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.543 0.211 . . . . 0.0 111.023 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.571 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.8 mt-10 -64.81 -36.45 84.37 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.282 179.508 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.765 ' HG2' ' HB3' ' A' ' 15' ' ' LEU . 2.4 tpt -61.3 -44.66 96.84 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 123.96 1.838 . . . . 0.0 108.407 177.445 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.757 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -68.28 -18.6 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 112.97 -1.923 . . . . 0.0 112.265 -177.543 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.14 -45.23 16.72 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.168 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.742 ' CG2' ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -60.39 -32.33 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.467 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 1.015 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.98 -42.0 1.3 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.163 -1.38 . . . . 0.0 110.536 177.83 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.696 ' HB3' ' HE1' ' B' ' 18' ' ' MET . 9.8 mt -83.12 -29.7 28.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.726 -179.674 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.444 ' N ' ' O ' ' A' ' 32' ' ' VAL . 8.5 mt-30 -87.67 -18.62 29.15 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.489 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 1.015 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -109.44 4.52 22.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.418 0.554 . . . . 0.0 112.412 179.687 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.593 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.9 t80 -79.85 145.61 32.65 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.661 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.475 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.729 -0.653 . . . . 0.0 112.245 179.48 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.795 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.908 0.385 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . 0.474 ' O ' ' HD3' ' B' ' 1' ' ' ARG . 99.2 m95 -69.26 174.84 4.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.697 179.896 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.528 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 tp -169.14 137.38 1.95 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -117.16 138.69 51.5 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.683 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.757 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.3 pp -161.81 173.63 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.222 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.7 t-105 -93.0 114.25 26.75 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.463 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.649 ' CD1' HG23 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -128.97 123.78 33.34 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.561 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.441 ' O ' HD22 ' B' ' 12' ' ' LEU . 11.6 p -81.5 -174.24 4.85 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.839 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.403 ' HA ' HD21 ' B' ' 12' ' ' LEU . 3.0 p-10 -63.3 -163.55 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.808 -178.827 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 35.37 41.75 0.09 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.447 0.699 . . . . 0.0 112.723 179.014 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.644 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 0.7 OUTLIER -178.38 -56.15 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.998 179.678 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.836 HD23 ' HD3' ' A' ' 1' ' ' ARG . 1.0 OUTLIER -61.97 -30.38 70.89 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.445 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -95.46 -35.87 11.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.06 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.644 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 6.6 t70 -44.69 -31.17 1.09 Allowed 'General case' 0 C--N 1.343 0.306 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.217 179.779 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.668 HD11 HG12 ' B' ' 30' ' ' ILE . 44.2 mt -67.64 14.69 0.05 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -83.23 -42.11 17.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.262 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.44 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 5.1 mtpm? -91.37 -21.62 20.9 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.368 179.009 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.833 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 2.6 mtm -83.98 -26.51 29.14 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.586 -179.731 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.725 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.22 -69.51 0.76 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.637 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.487 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -53.16 -67.82 0.22 Allowed 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.35 -33.71 14.13 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.365 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.565 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.3 mm-40 -85.5 -11.2 54.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.16 179.703 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.94 -9.1 78.42 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.624 -178.219 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.725 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 60.3 mt -75.76 177.77 6.63 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 121.543 0.687 . . . . 0.0 111.52 179.963 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.1 p -124.51 170.41 10.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.403 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 0.0 OUTLIER -44.98 -40.59 6.56 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.523 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.589 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 3.8 p -85.83 -51.37 6.45 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -179.802 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.564 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.9 mm-40 -64.04 -4.18 3.24 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 121.388 -0.125 . . . . 0.0 111.292 179.579 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.833 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 3.5 tpt -94.33 -50.3 5.31 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 177.666 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.668 HG12 HD11 ' B' ' 15' ' ' LEU . 0.7 OUTLIER -73.59 -36.66 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.911 0 CA-C-N 113.311 -1.768 . . . . 0.0 112.677 -178.426 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.428 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.62 -48.94 65.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.941 0.877 . . . . 0.0 109.441 177.344 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.564 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -59.92 -36.79 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.376 -179.851 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.593 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -50.74 -32.47 19.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.105 179.209 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.588 ' CD1' HD22 ' A' ' 15' ' ' LEU . 13.4 mt -90.64 -28.92 18.07 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.557 -177.634 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -68.92 -19.66 64.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.49 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -102.84 25.71 8.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.863 0.363 . . . . 0.0 110.382 177.101 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.68 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 1.4 t80 -103.8 144.49 31.42 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.667 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.68 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 2.1 mppt? . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.191 178.159 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.743 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.8 mpt_? . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 120.921 0.391 . . . . 0.0 111.661 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -100.19 121.19 41.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.48 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.504 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -132.44 137.07 47.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.49 -178.63 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 1.003 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -119.34 128.39 54.07 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.553 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.575 HG13 ' CD2' ' A' ' 7' ' ' LEU . 4.1 pt -151.29 -178.86 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.231 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.415 ' O ' ' HB2' ' B' ' 27' ' ' SER . 76.2 t-105 -93.52 96.39 9.84 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -177.097 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.688 HD13 HG23 ' B' ' 30' ' ' ILE . 1.4 mm? -121.54 117.73 27.5 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 176.39 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.609 ' C ' HD23 ' A' ' 12' ' ' LEU . 50.7 p -65.84 165.93 12.04 Favored 'General case' 0 N--CA 1.427 -1.589 0 CA-C-O 122.21 1.005 . . . . 0.0 111.283 -178.336 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.557 ' HA ' HD23 ' A' ' 12' ' ' LEU . 5.8 t70 -60.65 -35.74 76.96 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 113.237 -1.801 . . . . 0.0 113.077 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -71.37 32.25 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.629 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.72 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -171.18 -50.26 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 122.881 0.472 . . . . 0.0 111.787 178.618 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.782 ' CD2' ' HD2' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -56.3 -29.83 61.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.836 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.452 ' HG3' ' CG ' ' A' ' 9' ' ' ASP . 3.0 mm-40 -88.28 -38.24 15.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.321 -1.309 . . . . 0.0 108.571 177.393 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.72 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 4.7 t70 -44.72 -24.45 0.2 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.214 178.158 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.679 ' HB3' ' HG2' ' A' ' 29' ' ' MET . 50.1 mt -67.51 14.6 0.05 Allowed 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.325 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.8 mt-10 -87.01 -44.62 11.45 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -79.5 -22.77 43.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.067 178.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.941 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 5.0 mtm -90.25 -23.61 21.18 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.047 -179.167 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.732 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -102.3 -65.87 0.96 Allowed 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.4 mtp85 . . . . . 0 N--CA 1.468 0.459 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.013 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.732 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 68.2 mt . . . . . 0 N--CA 1.453 -0.31 0 CA-C-O 121.508 0.671 . . . . 0.0 111.301 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -124.91 172.31 9.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.916 178.755 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.456 ' HB3' ' CG2' ' B' ' 5' ' ' ILE . 0.6 OUTLIER -46.15 -39.8 10.14 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.139 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.674 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 1.3 p -87.87 -50.18 6.61 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.447 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.4 mt-10 -63.58 -6.32 5.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.624 0.249 . . . . 0.0 110.484 178.96 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.941 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.4 tpt -89.73 -50.01 6.31 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-O 122.562 1.173 . . . . 0.0 107.983 178.075 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.634 HG12 HD12 ' A' ' 15' ' ' LEU . 0.5 OUTLIER -73.77 -38.57 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.064 0 CA-C-N 113.202 -1.817 . . . . 0.0 112.444 -178.004 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.407 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -61.88 -46.76 88.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 122.091 0.948 . . . . 0.0 108.56 176.684 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.85 -41.22 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.219 -179.979 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.523 ' CB ' HD21 ' B' ' 34' ' ' LEU . . . -53.36 -34.79 58.98 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.656 178.915 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.646 HD23 ' HB3' ' B' ' 33' ' ' ALA . 10.3 mt -79.38 -29.07 41.91 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.256 -178.874 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -79.16 -16.98 55.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.785 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.9 m80 -102.95 2.61 35.34 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.594 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.663 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 1.9 t80 -67.4 -168.95 0.09 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.543 0.337 . . . . 0.0 111.078 179.718 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.45 ' CD ' ' C ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 C-N-CA 125.866 1.666 . . . . 0.0 112.818 -178.535 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.782 ' HD2' ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.819 0.343 . . . . 0.0 111.145 . . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.84 130.57 41.37 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.057 0.456 . . . . 0.0 110.941 -179.266 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -130.57 142.93 50.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.542 -178.859 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 1.003 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -127.87 132.84 49.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.739 179.108 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.551 ' CD1' HG13 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -150.27 -175.28 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.465 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.674 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 76.6 t-105 -103.79 92.32 4.37 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -177.252 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.628 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.6 OUTLIER -128.45 112.9 14.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.412 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.743 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.2 OUTLIER -86.35 -164.99 1.13 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.764 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -45.27 -66.46 0.4 Allowed 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.067 -1.424 . . . . 0.0 113.691 -178.044 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -47.88 -22.07 0.51 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.275 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.588 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 28.9 p -101.26 -35.5 9.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.433 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' B' ' 8' ' ' SER . 55.1 mt -69.7 -41.06 75.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 178.475 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -60.91 -41.86 96.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.84 -1.527 . . . . 0.0 107.442 175.858 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.602 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.3 OUTLIER -51.83 -39.28 58.55 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.172 178.367 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.664 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 27.0 mt -78.38 29.91 0.18 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.412 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -104.47 -59.51 1.73 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.452 ' HG3' ' N ' ' B' ' 18' ' ' MET . 6.7 pttm -71.32 -21.73 62.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.72 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.842 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 7.5 mtm -91.17 -18.45 24.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.193 -179.866 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.712 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -103.19 -67.15 0.9 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.909 179.101 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -59.98 -66.29 0.54 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 120.914 0.388 . . . . 0.0 112.034 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.7 -33.25 15.39 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' B' ' 18' ' ' MET . 6.8 mm-40 -85.87 -10.83 54.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.351 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.58 -10.75 73.64 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.9 -178.681 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.712 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 57.4 mt -71.99 177.26 4.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.606 0.717 . . . . 0.0 111.561 179.779 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 37.5 p -123.44 168.04 13.06 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.46 178.784 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.19 -40.82 5.34 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.357 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.564 ' HA ' HD13 ' A' ' 5' ' ' ILE . 2.2 p -83.68 -51.49 7.22 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.445 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.9 mm-40 -63.64 -7.21 6.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.654 0.264 . . . . 0.0 110.816 178.878 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.842 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.7 tpt -89.18 -49.47 6.72 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 177.781 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.688 HG23 HD13 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -72.35 -27.95 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.288 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.696 -178.335 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.444 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.83 -52.36 37.75 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.627 0.727 . . . . 0.0 109.785 177.204 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.444 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 10.0 p -63.88 -32.65 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.819 -177.392 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.848 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -49.36 -32.05 10.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.892 177.437 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.662 ' CD1' HD22 ' A' ' 15' ' ' LEU . 14.4 mt -88.72 -26.64 21.68 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.159 -177.121 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.84 -27.51 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -177.614 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.848 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 6.4 p-80 -89.43 -33.47 16.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.963 0.801 . . . . 0.0 111.022 177.627 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.429 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 20.4 t80 -35.89 144.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.998 0.519 . . . . 0.0 111.877 -179.533 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt . . . . . 0 C--O 1.25 1.101 0 C-N-CA 123.611 0.765 . . . . 0.0 112.178 178.938 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.534 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 111.652 0.242 . . . . 0.0 111.652 . . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -71.54 123.57 22.75 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.713 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.511 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.2 tp -122.1 132.66 54.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.655 -178.589 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -117.7 117.92 30.66 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.126 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.678 HD11 ' HA ' ' B' ' 27' ' ' SER . 5.5 pt -143.26 176.42 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.827 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.4 t-105 -98.74 105.25 17.37 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -177.025 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.674 HD12 HG23 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -128.7 123.63 33.57 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.781 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.508 ' O ' ' HB3' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -86.29 -163.48 0.89 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.171 -179.555 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.435 ' O ' HG23 ' A' ' 11' ' ' THR . 3.1 t70 -63.61 -165.14 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.381 -177.949 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.5 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.7 tt0 36.83 40.68 0.15 Allowed 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.543 0.737 . . . . 0.0 112.761 179.307 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.684 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 11.2 t 177.39 -51.21 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.274 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.716 HD22 ' HB2' ' B' ' 1' ' ' ARG . 0.5 OUTLIER -68.44 -30.19 69.01 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.516 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.78 -40.16 12.66 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 113.745 -1.57 . . . . 0.0 107.706 177.577 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.684 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -44.17 -28.88 0.55 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.803 179.266 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.626 HD23 ' CD1' ' B' ' 34' ' ' LEU . 34.9 mt -69.2 20.21 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.424 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -97.18 -44.32 6.99 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.674 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.424 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 21.7 mtpp -87.73 -26.86 22.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.77 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 7.6 mtm -82.39 -14.5 55.11 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.959 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.773 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -100.63 -64.66 1.02 Allowed 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.525 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 . . . . . 0 CA--C 1.516 -0.327 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -178.838 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.773 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 121.099 0.475 . . . . 0.0 111.587 . . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.419 ' N ' HD21 ' A' ' 24' ' ' LEU . 84.5 p -100.19 165.54 11.44 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.414 -178.791 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.429 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 1.1 mmmm -48.23 -35.72 12.46 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.614 ' HA ' HD13 ' B' ' 5' ' ' ILE . 1.5 m -78.55 -58.33 3.3 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 122.239 0.216 . . . . 0.0 110.781 179.88 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.478 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.0 mm-40 -57.77 -16.84 12.52 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 178.431 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.77 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 0.8 OUTLIER -75.42 -50.33 16.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 122.621 1.2 . . . . 0.0 108.115 177.86 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.584 HG21 HD12 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -70.63 -34.17 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.122 0 CA-C-N 113.007 -1.906 . . . . 0.0 113.069 -177.697 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.456 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.79 -49.03 67.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.046 0.927 . . . . 0.0 108.794 177.023 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.478 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -54.93 -42.1 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.626 -179.702 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.629 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -46.75 -36.15 6.93 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.188 179.367 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.703 HD22 ' HB3' ' B' ' 33' ' ' ALA . 10.5 mt -77.56 -37.1 51.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.009 -178.081 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.22 -17.05 62.52 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.484 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -107.02 27.23 9.21 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 177.142 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.745 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 9.8 t80 -117.08 146.7 42.95 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.667 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.589 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.1 0 C-N-CA 123.74 0.816 . . . . 0.0 112.117 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.716 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.159 0.504 . . . . 0.0 111.944 . . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -101.87 117.48 34.94 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.953 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.537 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 15.8 tp -108.12 132.88 53.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.531 -177.966 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -126.91 119.36 26.55 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.212 178.442 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.614 HD13 ' HA ' ' A' ' 27' ' ' SER . 1.0 OUTLIER -152.65 -178.23 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.363 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -93.49 91.48 7.15 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -177.726 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.633 ' HB3' HG21 ' B' ' 11' ' ' THR . 2.1 mm? -128.75 104.14 7.46 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.429 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.534 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 8.8 t -69.66 -135.71 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.891 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.416 ' C ' ' H ' ' B' ' 11' ' ' THR . 13.3 t70 -90.23 -38.76 13.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -177.631 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . 0.574 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 1.4 mt-30 -73.59 41.83 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.087 0.47 . . . . 0.0 111.717 -179.181 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.717 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 1.1 t -165.27 -37.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 178.826 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.532 ' N ' HG22 ' B' ' 11' ' ' THR . 15.4 mt -79.87 -42.87 23.33 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.112 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.35 -30.25 22.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.619 177.576 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.717 ' HB2' ' N ' ' B' ' 11' ' ' THR . 5.6 t70 -41.99 -19.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.002 -1.454 . . . . 0.0 113.333 -179.052 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.782 ' HB2' ' HG3' ' B' ' 18' ' ' MET . 0.0 OUTLIER -137.14 56.02 1.8 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 179.272 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.58 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 4.1 mt-10 -56.57 -25.27 51.84 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.929 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.656 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 9.1 mttp -84.68 -45.07 12.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.948 179.399 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.782 ' HG3' ' HB2' ' B' ' 15' ' ' LEU . 20.3 mtm -59.09 -25.89 64.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.796 0.331 . . . . 0.0 110.591 179.614 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.67 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -100.91 -64.82 1.01 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.352 179.581 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 2.9 mtp85 -67.06 -65.14 0.72 Allowed 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.112 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . 0.656 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.96 -34.33 20.51 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.512 -179.859 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.498 ' HB2' ' O ' ' B' ' 18' ' ' MET . 8.8 mm-40 -82.43 -14.53 54.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.017 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.9 -5.98 83.06 Favored Glycine 0 C--N 1.339 0.707 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.702 -178.546 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.67 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 76.6 mt -71.8 177.57 4.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 111.681 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 25' ' ' SER . . . . . 0.469 ' O ' ' HB3' ' B' ' 29' ' ' MET . 25.1 p -119.0 169.33 9.99 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.261 178.418 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.41 -37.66 17.61 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.678 ' HA ' HD11 ' A' ' 5' ' ' ILE . 6.0 p -87.02 -49.76 7.11 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.566 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.412 ' HB3' HD23 ' B' ' 24' ' ' LEU . 2.4 mm-40 -61.12 -11.62 9.45 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 121.046 -0.262 . . . . 0.0 111.019 179.686 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.72 ' C ' ' SD ' ' B' ' 29' ' ' MET . 0.0 OUTLIER -85.28 -43.05 14.08 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 176.748 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.674 HG23 HD12 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -78.99 -24.59 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-N 113.616 -1.629 . . . . 0.0 113.789 -176.942 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.523 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -66.26 -53.92 31.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.658 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.523 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 15.0 p -64.29 -32.6 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.673 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.333 -177.69 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.869 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -52.3 -27.97 17.26 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.651 177.195 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.629 HD23 ' CB ' ' A' ' 33' ' ' ALA . 13.4 mt -90.31 -27.15 19.61 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.416 -178.374 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -69.18 -37.25 78.06 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -178.049 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.869 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 4.5 p-80 -81.77 -41.45 21.16 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 118.952 0.796 . . . . 0.0 110.772 178.309 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.499 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 28.3 t80 -48.48 150.24 1.4 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.907 -179.42 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 117.947 -1.025 . . . . 0.0 112.3 178.172 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.658 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.096 0.474 . . . . 0.0 111.914 . . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -110.36 117.21 33.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 177.353 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.516 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -127.8 140.93 51.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.725 -177.883 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -120.73 129.87 53.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.414 178.624 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.642 HD12 ' HA ' ' B' ' 27' ' ' SER . 0.8 OUTLIER -150.85 -176.94 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.5 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.9 t-105 -92.69 94.79 9.19 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.591 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.579 HD13 HG21 ' B' ' 30' ' ' ILE . 1.8 mm? -130.36 105.44 7.89 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.3 177.76 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 51.8 p -67.7 -139.18 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.582 0.229 . . . . 0.0 110.941 -178.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -99.0 -142.64 0.32 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 119.558 -0.258 . . . . 0.0 111.386 -179.191 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 33.38 42.11 0.04 OUTLIER 'General case' 0 C--N 1.346 0.445 0 C-N-CA 123.455 0.702 . . . . 0.0 112.67 179.401 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.656 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -176.34 -49.9 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.989 179.488 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.446 HD21 ' CD2' ' B' ' 3' ' ' LEU . 47.7 mt -71.22 -39.8 71.49 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 176.016 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -40.44 65.0 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 113.134 -1.848 . . . . 0.0 107.04 176.088 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.656 ' CB ' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -49.39 -27.46 4.09 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 113.497 -1.683 . . . . 0.0 110.753 179.108 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.675 HD21 ' SD ' ' A' ' 29' ' ' MET . 74.3 mt -63.02 4.52 0.18 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -60.73 -59.04 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 179.49 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.4 pttp -85.76 -9.02 57.76 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.392 178.88 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.551 ' CE ' ' HB3' ' B' ' 34' ' ' LEU . 10.7 mtp -88.37 -23.46 23.37 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.944 179.48 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -101.35 -60.62 1.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.567 -179.796 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.6 mtp-105 . . . . . 0 CA--C 1.515 -0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 111.549 -179.716 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.81 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.612 0 CA-C-O 121.153 0.501 . . . . 0.0 111.748 . . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.464 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.7 OUTLIER -110.69 166.88 10.66 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.865 -178.696 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.428 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -38.11 -43.29 0.73 Allowed 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -179.271 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.596 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 4.4 m -78.45 -53.39 7.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.733 0.242 . . . . 0.0 111.295 -179.27 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.61 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mt-10 -64.37 -15.2 60.0 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 110.023 178.605 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.675 ' SD ' HD21 ' A' ' 15' ' ' LEU . 2.5 tpt -77.09 -46.93 21.92 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.245 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.663 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.0 -25.92 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.788 0 CA-C-N 112.834 -1.985 . . . . 0.0 112.716 -178.586 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.562 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.44 -51.25 58.87 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.674 0.749 . . . . 0.0 109.241 177.395 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.562 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 12.3 p -66.97 -31.69 54.59 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.679 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.56 -177.866 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.704 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -44.9 -34.07 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.32 177.406 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.625 ' CD1' HD22 ' B' ' 15' ' ' LEU . 8.8 mt -95.75 -24.92 16.28 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -177.769 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -69.69 -39.76 76.76 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.858 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.731 ' CD2' ' HA ' ' B' ' 37' ' ' TYR . 0.3 OUTLIER -64.12 -34.73 78.71 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.237 0.926 . . . . 0.0 110.225 178.247 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.651 ' CD1' ' N ' ' A' ' 38' ' ' LYS . 0.9 OUTLIER -48.83 141.71 7.16 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.076 -179.629 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.651 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 177.193 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 120.899 0.38 . . . . 0.0 111.571 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -79.42 133.79 36.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.859 179.603 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.2 tp -133.41 144.85 49.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.516 -178.647 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.3 OUTLIER -128.92 130.3 46.61 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.71 179.077 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.663 ' CD1' HG21 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -150.34 -173.86 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.579 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.596 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 67.0 t-105 -97.91 101.6 13.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.485 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.501 HD12 HG22 ' A' ' 30' ' ' ILE . 1.6 mm? -128.27 107.0 9.41 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.499 178.113 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.658 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 11.1 p -79.99 -172.95 3.66 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 121.508 0.671 . . . . 0.0 112.103 -178.492 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -48.96 -58.07 5.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.967 -179.55 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -50.48 -30.79 13.59 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.021 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.637 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 44.2 p -87.57 -34.7 18.47 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.776 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' B' ' 8' ' ' SER . 50.2 mt -68.58 -39.82 80.8 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 178.394 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.11 -41.52 94.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.53 -1.668 . . . . 0.0 108.365 176.496 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.647 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.3 OUTLIER -52.57 -46.44 66.87 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.086 179.036 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.698 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 23.9 mt -77.34 32.31 0.15 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.97 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -105.64 -55.7 2.29 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.226 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -82.13 -24.77 34.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.465 179.214 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.647 ' HG3' ' O ' ' B' ' 14' ' ' ASP . 8.0 mtm -85.08 -14.49 47.04 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.688 0.28 . . . . 0.0 110.451 179.294 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.83 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -99.92 -65.51 0.96 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.026 -179.891 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 22.3 mtp85 -58.56 -63.54 1.25 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.044 0.449 . . . . 0.0 111.502 -179.146 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.46 -34.75 17.59 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.549 179.381 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' B' ' 18' ' ' MET . 3.2 mm-40 -73.22 -28.64 62.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.145 178.907 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.65 -15.67 37.82 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.332 179.663 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.849 HD23 ' C ' ' B' ' 24' ' ' LEU . 0.0 OUTLIER -90.64 -172.51 3.42 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.197 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.1 p -114.28 170.73 8.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.699 -179.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.441 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 3.1 mttm -44.64 -39.77 5.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.428 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.642 ' HA ' HD12 ' A' ' 5' ' ' ILE . 13.2 m -71.94 -62.03 1.57 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.483 0.182 . . . . 0.0 110.906 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.663 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.6 mm-40 -57.95 -17.05 14.54 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.132 179.353 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.772 ' HB2' HD22 ' B' ' 24' ' ' LEU . 1.3 tpt -78.07 -45.78 22.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 123.601 1.667 . . . . 0.0 107.565 177.466 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.605 HG12 ' CD1' ' B' ' 15' ' ' LEU . 0.5 OUTLIER -67.73 -18.76 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.789 0 CA-C-N 112.845 -1.98 . . . . 0.0 112.21 -177.987 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.435 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -81.71 -44.96 16.37 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.67 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.767 ' HB ' ' CD2' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -60.41 -32.28 50.73 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.659 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.973 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -35.74 -40.04 0.17 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 113.656 -1.611 . . . . 0.0 110.967 178.325 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.656 ' CD1' HD22 ' A' ' 15' ' ' LEU . 4.0 mt -94.72 -28.38 15.34 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.259 -179.216 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' B' ' 32' ' ' VAL . 9.9 mt-30 -83.14 -30.13 28.1 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -179.375 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.973 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -94.3 19.43 9.48 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 117.909 0.322 . . . . 0.0 111.654 179.446 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.731 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -56.48 129.51 41.04 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -179.721 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.678 ' N ' ' HD1' ' B' ' 37' ' ' TYR . 1.4 mmmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 117.824 -1.084 . . . . 0.0 111.38 176.277 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 111.471 0.175 . . . . 0.0 111.471 . . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -80.58 113.13 18.56 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.465 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -122.95 141.33 52.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.058 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.992 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -116.96 128.73 55.49 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.975 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.602 HG13 HD22 ' A' ' 7' ' ' LEU . 1.9 pt -151.57 178.51 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.095 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -91.07 89.79 7.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -177.481 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.602 HD22 HG13 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -120.36 102.54 8.54 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.86 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.2 p -67.62 -140.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -177.061 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.435 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.6 t70 -95.28 -38.86 10.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.507 -178.011 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -72.55 39.45 0.08 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.946 0.498 . . . . 0.0 112.039 -179.153 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.778 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -163.59 -43.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.18 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.406 HD23 HD22 ' B' ' 3' ' ' LEU . 56.6 mt -68.12 -41.26 81.97 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.214 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.05 -38.46 90.91 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 113.416 -1.72 . . . . 0.0 107.917 176.07 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.778 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -51.78 -42.72 62.63 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.996 178.331 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.761 HD12 HG12 ' A' ' 30' ' ' ILE . 50.3 mt -73.31 -12.7 60.93 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.744 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.83 -42.31 71.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.62 0.247 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -92.93 -20.94 20.12 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.717 179.325 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.518 ' O ' ' N ' ' A' ' 20' ' ' ARG . 30.9 mtm -87.21 -61.31 1.75 Allowed 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -179.3 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.633 ' HA ' ' HB2' ' A' ' 29' ' ' MET . . . -25.18 -34.5 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 114.214 1.191 . . . . 0.0 114.214 -178.48 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 18' ' ' MET . 31.3 mmm-85 . . . . . 0 C--N 1.315 -0.892 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.797 179.643 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.86 ' CD2' ' HB3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.556 1.195 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 . . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.674 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 1.9 t 131.68 163.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 127.707 2.403 . . . . 0.0 109.495 177.904 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -69.24 -48.18 62.64 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.577 179.824 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.6 m -77.95 -30.77 50.56 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.261 178.101 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.86 ' HB3' ' CD2' ' A' ' 24' ' ' LEU . 2.6 mm-40 -73.31 -28.47 62.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.743 179.091 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.727 ' HE3' HG22 ' A' ' 32' ' ' VAL . 3.4 tpt -67.87 -46.08 72.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 123.759 1.742 . . . . 0.0 107.896 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.761 HG12 HD12 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -65.75 -18.45 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.037 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.845 -179.371 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -50.33 11.35 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.144 177.084 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.795 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -55.4 -34.47 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 178.562 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.97 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -35.56 -46.56 0.41 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.558 -1.655 . . . . 0.0 111.556 178.056 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.664 HD11 HD22 ' B' ' 15' ' ' LEU . 6.2 mt -83.5 -32.82 25.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.868 -179.092 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -81.05 -11.74 59.46 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 179.478 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.97 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -123.29 -4.93 8.34 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -179.529 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.641 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.7 OUTLIER -62.6 142.17 58.15 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.847 0.459 . . . . 0.0 110.52 179.88 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.863 -1.065 . . . . 0.0 112.262 178.763 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.544 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -73.81 127.3 32.45 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.048 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.1 tp -134.48 137.82 44.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.629 -178.869 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.992 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -111.07 128.54 55.91 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.804 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.512 HG13 HD21 ' B' ' 7' ' ' LEU . 4.0 pt -150.62 176.19 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.446 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -94.58 104.12 16.06 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.612 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.676 HD13 HG22 ' A' ' 30' ' ' ILE . 1.3 mm? -124.08 115.48 21.24 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 176.976 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 28.0 p -73.86 -135.91 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.637 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 12.9 t70 -96.49 -39.79 9.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -177.755 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -72.29 41.31 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.72 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.606 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 4.7 t -160.57 -44.49 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.307 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.546 ' N ' HG22 ' B' ' 11' ' ' THR . 17.6 mt -73.79 -41.9 61.74 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.677 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' B' ' 9' ' ' ASP . 1.9 mt-10 -76.32 -37.98 56.63 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 113.555 -1.657 . . . . 0.0 108.366 176.472 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.606 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -48.8 -32.14 8.21 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.227 178.304 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.803 HD13 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -82.13 32.89 0.39 Allowed 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 124.654 1.182 . . . . 0.0 112.923 179.906 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.553 ' HG2' ' N ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -81.84 -41.92 20.37 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.995 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . 0.553 ' N ' ' HG2' ' B' ' 16' ' ' GLU . 24.0 mtpp -115.59 24.07 11.85 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.626 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.565 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 35.6 mtp -110.83 -75.53 0.62 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.397 0.141 . . . . 0.0 111.356 -179.831 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.682 ' HA ' ' CA ' ' B' ' 23' ' ' GLY . . . -25.46 -32.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.865 1.666 . . . . 0.0 114.131 -177.913 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' B' ' 18' ' ' MET . 0.0 OUTLIER -62.5 -141.46 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.476 -0.489 . . . . 0.0 109.699 177.944 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . 0.468 ' N ' ' CG ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -43.43 -21.94 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.577 -0.702 . . . . 0.0 112.279 179.043 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' B' ' 20' ' ' ARG . 19.5 mm-40 -104.42 -12.93 16.28 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -177.769 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . 0.682 ' CA ' ' HA ' ' B' ' 19' ' ' ALA . . . -137.71 12.26 3.69 Favored Glycine 0 CA--C 1.501 -0.79 0 C-N-CA 116.804 -2.617 . . . . 0.0 116.962 -175.713 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' B' ' 19' ' ' ALA . 1.1 mp 53.55 -161.97 0.12 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 119.723 1.762 . . . . 0.0 112.622 177.038 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -64.14 158.85 21.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.438 178.895 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.48 -43.14 11.37 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 117.624 0.193 . . . . 0.0 111.509 -179.608 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -82.69 -50.28 8.89 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.883 -0.144 . . . . 0.0 111.078 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.475 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.2 mm-40 -54.07 -30.12 46.91 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.799 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.803 ' SD ' HD13 ' B' ' 15' ' ' LEU . 3.5 tpt -60.39 -47.58 85.45 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 122.82 1.295 . . . . 0.0 109.821 177.603 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.643 HG12 HD23 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -79.28 -29.47 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.43 0 CA-C-N 112.407 -2.179 . . . . 0.0 114.056 -175.341 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -70.58 -48.16 56.64 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.297 1.046 . . . . 0.0 108.931 177.079 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . 0.484 HG22 HD13 ' B' ' 24' ' ' LEU . 2.1 t -58.96 -47.07 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.469 -179.304 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.707 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . . . -45.18 -34.81 2.91 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.804 179.686 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.577 HD13 HD22 ' A' ' 15' ' ' LEU . 13.6 mt -83.78 -30.46 26.58 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.398 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -80.36 -9.19 59.74 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.951 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -120.43 25.86 9.54 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 120.71 0.29 . . . . 0.0 111.153 177.961 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.596 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 22.1 t80 -132.96 163.55 28.94 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.744 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.595 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.5 tppt? . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.137 178.757 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.211 0.053 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -79.69 120.17 23.63 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.998 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 mm? -131.48 153.63 49.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.494 -178.995 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.989 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -126.65 127.56 45.37 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.329 178.829 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.622 HD12 ' HA ' ' B' ' 27' ' ' SER . 2.7 pt -145.32 176.49 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.446 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -96.2 95.06 7.87 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.156 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.615 HD13 HG22 ' B' ' 30' ' ' ILE . 1.3 mm? -124.9 108.23 11.69 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.298 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.0 p -72.37 -136.79 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.535 0.207 . . . . 0.0 111.07 -178.867 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -88.14 -156.46 0.36 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 119.798 -0.144 . . . . 0.0 110.932 -179.535 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.15 44.1 0.09 Allowed 'General case' 0 C--N 1.346 0.413 0 C-N-CA 123.229 0.611 . . . . 0.0 112.089 179.24 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.689 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 7.8 t -172.65 -46.45 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.714 179.673 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.408 ' H ' HG22 ' A' ' 11' ' ' THR . 34.5 mt -73.57 -42.58 61.44 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 175.774 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.96 -39.61 83.34 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 113.323 -1.762 . . . . 0.0 107.081 175.657 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.689 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.9 t70 -49.46 -30.69 8.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.015 -1.448 . . . . 0.0 110.415 178.581 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.73 HD23 ' SD ' ' A' ' 29' ' ' MET . 45.6 mt -73.51 22.73 0.07 Allowed 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.703 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -83.85 -66.1 0.93 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 122.17 -0.332 . . . . 0.0 110.551 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.75 -15.22 60.3 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.712 179.528 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.739 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 15.7 mtm -87.1 -27.37 23.16 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.37 -179.861 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.816 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -102.13 -59.38 1.71 Allowed 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.354 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.513 -0.475 0 CA-C-O 120.902 0.382 . . . . 0.0 111.601 -179.171 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.816 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 120.922 0.391 . . . . 0.0 111.9 . . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.538 ' N ' HD23 ' A' ' 24' ' ' LEU . 19.3 p -113.76 169.6 8.87 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.779 -178.655 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.555 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -37.48 -42.4 0.51 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -179.385 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.673 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 29.2 p -72.42 -62.46 1.43 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.363 0.265 . . . . 0.0 111.586 -179.644 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.617 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mm-40 -58.56 -13.16 5.04 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.594 179.074 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.739 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.6 tpt -82.39 -48.25 11.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 122.736 1.255 . . . . 0.0 108.302 178.311 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.555 ' HB ' ' O ' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -74.51 -36.24 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.106 0 CA-C-N 112.806 -1.997 . . . . 0.0 112.916 -177.696 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.45 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -64.18 -47.04 81.37 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.136 0.969 . . . . 0.0 108.75 176.864 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.96 -42.3 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 113.239 -1.801 . . . . 0.0 111.422 -179.584 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.639 ' CB ' HD21 ' B' ' 34' ' ' LEU . . . -50.82 -42.27 58.26 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.443 179.622 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.678 HD13 HD23 ' B' ' 15' ' ' LEU . 9.4 mt -73.76 -34.32 64.65 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.617 -178.037 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -74.46 -13.57 60.72 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.451 ' HD1' HG13 ' A' ' 32' ' ' VAL . 60.1 m80 -107.85 -40.1 5.36 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 177.983 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.63 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.4 t80 -29.33 133.02 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.038 0.535 . . . . 0.0 111.963 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.458 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.058 178.147 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 1' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 . . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -78.97 122.37 26.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 178.963 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 3' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -130.57 152.5 49.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.334 -179.271 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 4' ' ' CYS . . . . . 0.989 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -125.67 128.31 47.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.532 178.956 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.501 HD11 HG22 ' A' ' 30' ' ' ILE . 2.3 pp -151.21 169.45 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-O 121.037 0.446 . . . . 0.0 112.118 -178.801 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.673 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 68.4 t-105 -81.19 90.51 6.08 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.74 0.781 . . . . 0.0 111.29 -179.594 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.59 ' HG ' ' CG2' ' B' ' 11' ' ' THR . 12.7 tp -107.17 95.39 5.68 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 178.537 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 8' ' ' SER . . . . . 0.57 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 6.0 p -81.34 -157.94 0.19 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.96 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 9' ' ' ASP . . . . . 0.404 ' C ' ' H ' ' B' ' 11' ' ' THR . 13.2 t70 -66.08 -41.57 90.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.913 -178.125 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -74.33 42.28 0.15 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.147 0.499 . . . . 0.0 111.346 -179.54 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 11' ' ' THR . . . . . 0.603 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 9.5 t -167.83 -43.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -179.822 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' B' ' 8' ' ' SER . 28.1 mt -69.9 -41.65 74.41 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.26 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' B' ' 16' ' ' GLU . 2.7 mt-10 -73.97 -41.35 62.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.37 -1.741 . . . . 0.0 108.187 176.582 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 14' ' ' ASP . . . . . 0.603 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -49.07 -27.31 3.25 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.091 178.519 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . 0.827 HD12 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.57 40.56 0.59 Allowed 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 124.134 0.974 . . . . 0.0 112.385 179.883 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' B' ' 13' ' ' GLU . 7.1 mt-10 -74.59 -66.82 0.69 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.475 179.823 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -107.89 33.39 4.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.231 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 18' ' ' MET . . . . . 0.799 ' HB2' HD12 ' B' ' 15' ' ' LEU . 3.2 mtm -105.36 -84.52 0.5 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 122.322 -0.236 . . . . 0.0 110.684 179.679 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . 0.754 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -48.49 -49.27 36.45 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.26 0.624 . . . . 0.0 111.693 179.873 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -61.33 -65.4 0.7 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.156 0.503 . . . . 0.0 111.26 -179.639 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -32.52 27.79 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.28 179.368 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 22' ' ' GLU . . . . . 0.526 ' HB2' ' O ' ' B' ' 18' ' ' MET . 18.5 mm-40 -91.22 -6.8 52.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.22 4.45 68.54 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.295 -0.955 . . . . 0.0 111.666 -178.03 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 24' ' ' LEU . . . . . 0.754 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.1 mt -78.92 169.48 18.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.501 0.667 . . . . 0.0 111.174 179.911 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 92.5 p -112.24 161.06 17.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.477 178.036 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.38 -37.14 0.96 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.48 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 27' ' ' SER . . . . . 0.622 ' HA ' HD12 ' A' ' 5' ' ' ILE . 1.5 m -83.26 -58.12 2.97 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.644 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 28' ' ' GLU . . . . . 0.403 ' HB3' HD21 ' B' ' 24' ' ' LEU . 3.2 mt-10 -59.09 -13.85 8.2 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.496 178.944 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 29' ' ' MET . . . . . 0.827 ' SD ' HD12 ' B' ' 15' ' ' LEU . 3.3 tpt -80.76 -47.17 14.3 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 122.679 1.228 . . . . 0.0 108.494 178.059 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.615 HG22 HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -75.94 -28.97 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.206 0 CA-C-N 112.794 -2.003 . . . . 0.0 113.219 -177.319 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.404 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -68.2 -48.55 64.9 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 122.329 1.062 . . . . 0.0 108.668 177.105 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.97 -48.28 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.577 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.794 -179.533 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 33' ' ' ALA . . . . . 0.642 ' CB ' HD21 ' A' ' 34' ' ' LEU . . . -47.76 -38.49 15.61 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.49 179.051 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.639 HD21 ' CB ' ' A' ' 33' ' ' ALA . 11.6 mt -74.67 -31.07 61.81 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.957 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -82.69 -13.82 55.7 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.111 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -124.78 21.66 8.3 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.786 0.327 . . . . 0.0 111.4 177.889 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.548 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 0.6 OUTLIER -81.1 131.79 35.32 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.66 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.46 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.121 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 178.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.664 ' HB2' HD21 ' B' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 120.982 0.42 . . . . 0.0 111.968 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -96.0 118.99 33.7 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 4.5 tp -118.54 134.84 54.78 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.228 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -124.46 127.57 47.69 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.085 178.535 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.535 HD11 HG23 ' B' ' 30' ' ' ILE . 1.1 pt -152.91 -176.51 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 -97.03 93.15 6.42 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -177.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.655 HD12 HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -128.04 109.34 11.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 177.392 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.731 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 9.1 p -79.13 -176.29 5.05 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -43.39 -59.12 2.25 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 113.769 -1.559 . . . . 0.0 112.992 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -47.43 -26.25 1.29 Allowed 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.574 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 21.9 p -101.25 -29.41 12.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 8' ' ' SER . 43.6 mt -73.54 -40.68 63.79 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 178.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.99 -40.71 94.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.551 175.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.577 ' O ' ' HG3' ' A' ' 18' ' ' MET . 0.1 OUTLIER -52.8 -48.22 67.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.282 -1.326 . . . . 0.0 109.282 178.131 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.641 HD21 ' CG ' ' A' ' 29' ' ' MET . 15.6 mt -71.61 9.92 0.76 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.457 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -102.53 -48.62 4.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.561 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.457 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 30.3 mttm -72.25 -40.8 67.43 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.017 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.681 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 43.4 mtm -68.97 -63.81 0.99 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.714 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.643 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -47.46 -49.48 25.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.745 0.418 . . . . 0.0 111.676 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.421 ' HD3' ' O ' ' A' ' 16' ' ' GLU . 15.9 mtp85 -58.26 -67.58 0.34 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.013 0.435 . . . . 0.0 111.627 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -30.84 22.76 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.153 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 18' ' ' MET . 20.2 mm-40 -88.36 -8.6 54.8 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.358 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.2 7.16 76.73 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 120.454 -0.879 . . . . 0.0 111.376 -177.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.643 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 95.5 mt -85.66 169.3 13.6 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.632 0.73 . . . . 0.0 111.561 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 m -114.01 166.05 11.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.335 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.9 -40.1 1.3 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.57 ' HA ' HD13 ' B' ' 5' ' ' ILE . 1.5 m -84.13 -54.2 4.99 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 111.532 0.197 . . . . 0.0 111.532 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.48 ' HB3' HD23 ' A' ' 24' ' ' LEU . 2.3 mm-40 -61.69 -10.74 9.31 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 120.722 0.296 . . . . 0.0 111.063 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.681 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.6 tpt -83.59 -47.32 11.41 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.69 1.233 . . . . 0.0 107.719 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.627 HG21 HD13 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -74.5 -31.53 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 CA-C-N 113.114 -1.857 . . . . 0.0 113.397 -178.167 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.54 -46.9 77.78 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.414 1.102 . . . . 0.0 108.555 177.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.2 t -58.97 -47.37 90.03 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.595 0 CA-C-N 112.752 -2.022 . . . . 0.0 111.048 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.696 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -48.8 -37.69 19.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.29 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.555 HD21 ' CB ' ' B' ' 33' ' ' ALA . 13.4 mt -77.98 -29.74 49.86 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.973 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -79.47 -16.14 56.59 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -125.44 14.98 8.26 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.488 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.4 OUTLIER -71.64 137.7 48.1 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.182 0 C-N-CA 123.383 0.673 . . . . 0.0 112.259 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.731 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.5 mpt_? . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.808 0.337 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -99.56 119.83 38.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.602 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.9 tp -130.95 135.03 47.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.412 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -117.88 128.84 55.22 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.547 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.57 HD13 ' HA ' ' A' ' 27' ' ' SER . 4.6 pt -147.77 178.65 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.468 ' O ' ' HB3' ' A' ' 27' ' ' SER . 73.8 t-105 -99.75 103.14 14.77 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -176.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.627 HD13 HG21 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -126.23 118.97 26.25 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 177.084 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.521 ' O ' ' HB3' ' B' ' 12' ' ' LEU . 0.3 OUTLIER -84.06 -161.49 0.55 Allowed 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.857 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.433 ' O ' HG21 ' B' ' 11' ' ' THR . 2.6 p-10 -61.53 -168.6 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.359 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . 0.47 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.9 tt0 37.65 41.59 0.32 Allowed 'General case' 0 C--N 1.345 0.373 0 C-N-CA 123.456 0.702 . . . . 0.0 112.771 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.661 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 11.5 t 177.32 -51.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.83 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.664 HD21 ' HB2' ' A' ' 1' ' ' ARG . 0.5 OUTLIER -67.49 -30.46 70.16 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 176.32 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -91.85 -38.64 12.21 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.424 177.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.661 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.1 t70 -44.39 -27.04 0.39 Allowed 'General case' 0 C--N 1.342 0.259 0 CA-C-N 114.438 -1.256 . . . . 0.0 111.045 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.657 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 33.2 mt -70.75 25.2 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 31.9 mt-10 -101.64 -55.75 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -75.18 -23.38 57.69 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.355 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.869 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 19.2 mtm -87.14 -22.28 25.44 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.102 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.739 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.72 -66.42 0.92 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.252 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.9 mtt-85 -58.13 -65.1 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.978 0.418 . . . . 0.0 111.854 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.11 -33.26 18.15 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.275 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.514 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.6 mm-40 -87.39 -9.41 54.84 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.423 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.14 -8.26 77.36 Favored Glycine 0 C--N 1.339 0.696 0 C-N-CA 120.705 -0.759 . . . . 0.0 111.762 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.739 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 78.1 mt -72.14 174.89 6.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.541 0.686 . . . . 0.0 111.495 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.5 p -120.2 166.04 13.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.547 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.97 -39.45 4.07 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m -83.82 -53.08 5.87 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 121.996 0.119 . . . . 0.0 111.205 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.33 -7.37 6.18 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.716 0.294 . . . . 0.0 110.737 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.869 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.4 tpt -87.09 -48.56 7.98 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 122.632 1.206 . . . . 0.0 107.968 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.655 HG22 HD12 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -75.81 -36.75 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.08 0 CA-C-N 112.988 -1.915 . . . . 0.0 112.926 -177.81 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.43 -46.17 87.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.313 1.054 . . . . 0.0 108.585 177.129 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.42 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -60.07 -44.68 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 CA-C-N 112.919 -1.946 . . . . 0.0 110.759 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.555 ' CB ' HD21 ' A' ' 34' ' ' LEU . . . -51.11 -39.48 56.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.352 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.553 HD11 HD23 ' A' ' 15' ' ' LEU . 12.9 mt -73.28 -30.34 63.35 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.318 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -76.5 -19.47 57.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -129.73 20.44 5.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.696 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -72.8 134.11 44.78 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.702 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 2.3 mmpt? . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.453 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.782 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.783 0.325 . . . . 0.0 111.479 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.516 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 98.1 m95 -70.85 163.96 26.28 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.635 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.9 tp -163.74 142.99 8.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.501 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -123.79 134.59 53.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.699 178.954 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.542 HG13 HD21 ' A' ' 7' ' ' LEU . 1.8 pt -150.05 179.3 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -95.9 92.66 6.62 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.636 HD11 HG21 ' B' ' 30' ' ' ILE . 1.5 mm? -122.91 114.61 20.68 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.534 ' O ' HD23 ' A' ' 12' ' ' LEU . 27.0 p -72.68 -179.58 3.14 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.421 0.629 . . . . 0.0 110.27 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -60.55 -160.48 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.379 -178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.481 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.87 43.27 0.27 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 123.634 0.773 . . . . 0.0 113.006 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.691 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t 177.44 -50.28 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.64 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.725 HD21 ' HD2' ' B' ' 1' ' ' ARG . 0.7 OUTLIER -70.84 -30.79 67.3 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -89.24 -37.93 14.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.566 -1.652 . . . . 0.0 107.936 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.691 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -50.61 -17.42 0.51 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.335 -1.302 . . . . 0.0 111.156 178.639 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.724 ' HB3' ' HG2' ' A' ' 29' ' ' MET . 49.1 mt -69.04 25.75 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 179.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.433 ' H ' ' C ' ' A' ' 14' ' ' ASP . 17.0 mm-40 -97.94 -54.27 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.566 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -71.32 -21.47 62.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.282 179.144 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.912 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 8.6 mtm -90.77 -23.05 20.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.709 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.711 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -101.13 -64.77 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.545 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 -54.12 -67.18 0.28 Allowed 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.566 ' HG3' ' HE3' ' A' ' 17' ' ' LYS . 13.6 mmp_? -51.22 -29.13 13.32 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.422 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.481 ' HB2' ' O ' ' A' ' 18' ' ' MET . 20.7 mm-40 -89.91 -8.24 52.3 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.255 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.82 -6.88 76.7 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 120.69 -0.766 . . . . 0.0 111.721 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.711 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.9 mt -74.67 173.79 9.99 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.582 0.706 . . . . 0.0 111.485 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.5 p -117.57 168.18 10.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.455 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.5 mmmm -46.39 -39.77 10.97 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.602 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 2.3 m -84.56 -52.34 6.2 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.132 0.173 . . . . 0.0 111.408 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.432 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.3 mm-40 -62.55 -7.28 4.39 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.7 0.286 . . . . 0.0 110.738 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.912 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.8 tpt -87.1 -48.5 8.03 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 122.657 1.218 . . . . 0.0 107.97 177.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.674 ' CG2' HD13 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -76.12 -37.94 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.981 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.911 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.407 HD21 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -62.92 -45.22 93.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 122.335 1.064 . . . . 0.0 108.604 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -62.23 -42.9 97.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 112.85 -1.977 . . . . 0.0 111.328 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.599 ' CB ' HD22 ' B' ' 34' ' ' LEU . . . -50.39 -35.39 28.04 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.521 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.594 HD23 ' CB ' ' B' ' 33' ' ' ALA . 15.3 mt -76.45 -31.11 57.65 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.35 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -77.68 -16.49 58.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -126.57 16.85 7.56 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.505 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.3 OUTLIER -70.51 137.75 50.46 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.128 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.848 -1.072 . . . . 0.0 112.265 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.725 ' HD2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 120.829 0.347 . . . . 0.0 111.487 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.83 156.66 39.05 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.015 0.436 . . . . 0.0 110.065 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.515 HD23 HD11 ' B' ' 5' ' ' ILE . 4.8 tp -159.38 139.23 11.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.157 -178.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -122.8 133.94 54.43 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.218 179.439 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.59 HD13 HG21 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -154.79 -176.8 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.699 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.602 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 70.6 t-105 -92.51 88.2 6.26 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.674 HD13 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -127.33 96.62 4.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.782 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 31.0 p -65.94 179.93 0.82 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.882 0.849 . . . . 0.0 112.806 -177.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -50.62 -54.14 25.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.337 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -49.82 -26.14 3.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.569 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 25.3 p -90.97 -28.85 17.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.461 HD23 HD12 ' A' ' 3' ' ' LEU . 21.1 mt -76.24 -39.35 54.72 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -60.21 -41.03 92.14 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 113.643 -1.617 . . . . 0.0 107.229 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.598 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -53.94 -40.2 66.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.906 178.231 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.688 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 39.2 mt -77.01 29.41 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -99.5 -61.18 1.4 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -74.34 -22.99 58.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.439 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.698 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.9 mtm -85.65 -21.61 28.32 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.84 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.91 -67.5 0.84 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -55.81 -63.04 1.3 Allowed 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.969 0.414 . . . . 0.0 111.558 -179.152 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.22 -33.95 9.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.513 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' B' ' 18' ' ' MET . 13.7 mm-40 -76.22 -28.96 57.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.571 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 102.88 -12.41 56.2 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 121.201 -0.523 . . . . 0.0 113.012 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.84 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -87.86 -174.51 4.76 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -179.341 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.0 p -105.02 167.28 9.81 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.93 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' B' ' 29' ' ' MET . 0.4 OUTLIER -49.8 -37.8 31.7 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.469 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.491 ' HA ' HD12 ' A' ' 5' ' ' ILE . 4.3 m -79.03 -55.88 4.8 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.418 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.9 mt-10 -56.36 -20.12 17.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.732 ' HB2' HD23 ' B' ' 24' ' ' LEU . 1.6 tpt -70.87 -46.68 62.21 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 122.61 1.195 . . . . 0.0 108.68 177.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.636 HG21 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -75.57 -31.55 23.47 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.298 0 CA-C-N 113.047 -1.888 . . . . 0.0 113.254 -177.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.404 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -65.78 -46.47 78.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 122.397 1.094 . . . . 0.0 108.339 176.318 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.404 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.6 t -58.36 -44.69 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-N 112.711 -2.04 . . . . 0.0 111.142 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.594 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -51.08 -32.18 21.41 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.63 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.651 ' CD1' HD21 ' A' ' 15' ' ' LEU . 18.6 mt -79.2 -31.39 43.77 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.857 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -78.8 -16.3 57.32 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.0 m80 -124.99 16.88 8.53 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.507 ' CE1' ' HB2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -69.96 138.93 52.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.119 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.507 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.171 0 CA-C-O 118.83 -0.605 . . . . 0.0 111.902 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -98.57 105.63 17.8 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tp -125.54 139.25 53.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.712 -178.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.991 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 6.5 m -96.0 139.51 32.08 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.605 HD12 HD22 ' A' ' 7' ' ' LEU . 1.1 pp -152.12 174.06 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.125 0.488 . . . . 0.0 112.227 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.59 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 70.8 t-105 -90.34 106.76 18.71 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -176.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.605 HD22 HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -133.15 115.65 15.31 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.446 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.546 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.6 p -89.37 -173.77 4.13 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.494 0.664 . . . . 0.0 111.875 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -49.65 -58.01 6.1 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.025 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -50.86 -27.28 7.09 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.583 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 28.1 p -91.83 -31.23 15.8 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.205 0.816 . . . . 0.0 113.205 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 8' ' ' SER . 46.1 mt -72.17 -40.55 67.88 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.49 -41.2 98.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.079 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.583 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.16 -44.88 61.55 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.404 178.949 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.631 HD21 HD12 ' B' ' 34' ' ' LEU . 22.9 mt -79.41 24.87 0.33 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -104.47 -58.81 1.83 Allowed 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -73.86 -32.03 63.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.425 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.558 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 43.1 mtm -74.09 -61.72 1.75 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.224 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.85 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -51.8 -48.38 63.87 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 -58.87 -66.68 0.46 Allowed 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 121.031 0.443 . . . . 0.0 111.218 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.55 -32.11 17.57 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.572 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 18' ' ' MET . 13.8 mm-40 -75.59 -26.12 57.61 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.815 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.19 13.44 80.82 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.949 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.85 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -110.32 177.56 4.66 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 111.854 -179.828 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.3 p -104.03 165.68 10.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.723 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.499 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 6.9 mttm -40.74 -41.39 1.53 Allowed 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.564 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 85.3 p -73.43 -59.3 2.78 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.326 0.108 . . . . 0.0 111.022 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.535 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 1.8 mm-40 -57.21 -22.07 38.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.176 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.716 ' HB2' HD23 ' A' ' 24' ' ' LEU . 3.6 tpt -71.67 -48.43 47.61 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.891 1.329 . . . . 0.0 108.751 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.612 HG23 ' CD1' ' B' ' 5' ' ' ILE . 0.4 OUTLIER -76.32 -31.74 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.266 0 CA-C-N 112.713 -2.039 . . . . 0.0 114.185 -176.588 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.443 ' O ' HD23 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -70.17 -47.29 62.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 122.155 0.979 . . . . 0.0 109.797 178.383 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.535 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -65.02 -39.14 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-N 113.309 -1.768 . . . . 0.0 111.122 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.631 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -42.87 -61.56 1.24 Allowed 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.419 -1.264 . . . . 0.0 112.169 -179.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.705 ' C ' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -75.07 -28.69 60.45 Favored 'General case' 0 N--CA 1.432 -1.37 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.636 -177.019 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.602 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 8.1 mt-30 -58.17 -20.22 39.18 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.333 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -120.41 25.09 10.02 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.2 0.524 . . . . 0.0 109.683 175.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.629 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -91.5 141.21 28.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.153 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.152 0 C-N-CA 123.471 0.708 . . . . 0.0 112.16 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 2.1 mpt_? . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.858 0.361 . . . . 0.0 111.679 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -109.98 109.27 19.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.475 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.4 tp -134.46 144.25 48.0 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.205 -178.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.991 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -96.46 137.1 36.04 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.612 ' CD1' HG23 ' A' ' 30' ' ' ILE . 4.4 pt -137.41 170.84 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.564 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 75.1 t-105 -100.31 106.81 18.47 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -177.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.495 ' CD2' HG13 ' B' ' 5' ' ' ILE . 0.7 OUTLIER -126.85 114.64 18.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.921 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.568 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 14.3 p -83.04 178.11 8.29 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.814 0.816 . . . . 0.0 112.13 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -51.7 -50.73 59.89 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.921 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -45.46 -35.68 3.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.474 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.771 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -104.7 -14.22 15.65 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' B' ' 8' ' ' SER . 94.1 mt -65.07 -39.25 92.97 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.13 -43.93 93.76 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 113.496 -1.684 . . . . 0.0 107.98 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.771 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -52.67 -40.29 62.74 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.545 178.839 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.625 ' CD2' ' HG ' ' A' ' 34' ' ' LEU . 14.6 mt -77.95 28.96 0.17 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -104.16 -61.54 1.43 Allowed 'General case' 0 N--CA 1.461 0.11 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.459 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 16.6 mtpp -71.87 -21.74 61.61 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.345 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.771 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 25.7 mtm -90.22 -24.72 20.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.399 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.681 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -104.16 -64.38 1.11 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.515 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 10.7 mtp-105 -60.16 -65.74 0.63 Allowed 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 120.998 0.428 . . . . 0.0 111.69 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . 0.459 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -50.6 -33.43 22.06 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.421 179.826 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' B' ' 18' ' ' MET . 16.1 mm-40 -84.84 -11.18 56.22 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.174 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.08 -5.67 84.74 Favored Glycine 0 C--N 1.339 0.737 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.856 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.681 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 72.4 mt -75.49 175.58 8.36 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.568 0.699 . . . . 0.0 111.295 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 10.6 p -119.76 174.5 6.39 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.652 -1.158 . . . . 0.0 108.8 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.494 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.0 mttm -51.14 -29.54 13.84 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 111.687 0.254 . . . . 0.0 111.687 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.59 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 34.5 m -82.51 -60.58 2.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.529 0.332 . . . . 0.0 111.496 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.55 ' HB3' ' CD2' ' B' ' 24' ' ' LEU . 2.6 mt-10 -61.03 -9.19 4.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.221 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.771 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.9 tpt -86.58 -46.62 9.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.546 HG23 HD13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -75.22 -32.89 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 CA-C-N 113.042 -1.89 . . . . 0.0 113.282 -178.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.487 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -70.78 -50.37 36.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 122.119 0.961 . . . . 0.0 109.203 177.776 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.487 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -54.79 -40.31 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 CA-C-N 113.212 -1.813 . . . . 0.0 109.844 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.691 ' CB ' ' HB3' ' A' ' 34' ' ' LEU . . . -44.44 -43.69 7.94 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.894 -1.503 . . . . 0.0 111.242 178.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.631 HD12 HD21 ' A' ' 15' ' ' LEU . 9.4 mt -78.54 -29.25 46.29 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.148 -177.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -70.66 -25.43 63.0 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -133.4 21.65 4.0 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.631 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -64.58 140.21 58.84 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 177.778 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.479 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.661 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.543 ' HB3' ' CD2' ' B' ' 12' ' ' LEU . 1.5 ttt-85 . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.35 118.57 25.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.53 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 mm? -131.46 148.92 52.69 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.436 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.982 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -117.04 128.6 55.32 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.436 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.617 ' CD1' ' HB2' ' A' ' 7' ' ' LEU . 2.4 pp -154.92 172.41 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.774 0.321 . . . . 0.0 111.387 -178.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.588 ' O ' ' HB2' ' B' ' 27' ' ' SER . 57.9 t-105 -79.56 78.21 6.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.553 0.692 . . . . 0.0 111.088 -179.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.636 ' HG ' HD21 ' A' ' 12' ' ' LEU . 54.2 tp -115.54 76.14 0.99 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.751 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 24.3 p -76.1 -145.04 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.475 -177.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.13 -155.28 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.245 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.53 44.43 0.11 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.323 0.649 . . . . 0.0 112.299 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.747 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 0.6 OUTLIER -178.5 -50.34 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.432 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.636 HD21 ' HG ' ' A' ' 7' ' ' LEU . 19.1 mt -70.17 -41.09 74.23 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 175.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -79.09 -39.78 32.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.037 -1.892 . . . . 0.0 108.323 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.747 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -50.6 -29.08 10.01 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.796 178.623 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.778 ' CD1' ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -77.38 31.8 0.15 Allowed 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.217 1.007 . . . . 0.0 112.929 179.71 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -76.61 -59.81 2.61 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -96.71 13.13 29.45 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.628 ' HB2' HD13 ' A' ' 15' ' ' LEU . 8.5 mtm -102.08 -76.68 0.57 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.09 0.405 . . . . 0.0 111.271 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.76 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -26.39 -32.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 126.507 1.923 . . . . 0.0 114.377 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 18' ' ' MET . 31.4 mmm-85 -66.92 -122.72 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.344 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -53.21 -21.94 5.96 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 121.973 -0.454 . . . . 0.0 111.881 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -113.53 -1.55 14.08 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 115.594 1.701 . . . . 0.0 115.594 -176.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.76 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -143.87 14.09 2.17 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 116.197 -2.906 . . . . 0.0 116.852 -176.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.478 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp 53.34 -161.52 0.12 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 119.312 1.556 . . . . 0.0 112.953 176.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -65.09 167.57 7.82 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.171 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -43.05 64.19 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' B' ' 6' ' ' TRP . 23.7 p -83.81 -47.52 11.03 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.892 -0.14 . . . . 0.0 111.086 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.401 ' HB3' ' HB3' ' A' ' 24' ' ' LEU . 2.8 mt-10 -56.04 -30.5 62.0 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.778 ' SD ' ' CD1' ' A' ' 15' ' ' LEU . 4.7 tpt -59.83 -47.83 84.12 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 122.69 1.233 . . . . 0.0 109.952 177.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.618 HG23 ' CD1' ' B' ' 7' ' ' LEU . 0.3 OUTLIER -79.34 -27.09 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.508 0 CA-C-N 112.828 -1.987 . . . . 0.0 114.099 -175.471 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.436 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -70.62 -48.68 53.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 122.286 1.041 . . . . 0.0 108.82 176.664 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.442 ' CG2' HD13 ' A' ' 24' ' ' LEU . 1.7 t -60.17 -46.19 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-N 112.986 -1.916 . . . . 0.0 111.553 -179.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.686 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -45.54 -40.6 8.84 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.236 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.629 HD21 ' HB1' ' B' ' 33' ' ' ALA . 11.4 mt -80.5 -28.8 37.39 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.245 -177.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -71.91 -13.94 61.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.509 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.6 m80 -129.83 46.25 2.68 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.572 0.225 . . . . 0.0 111.153 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.736 ' HA ' ' CD2' ' B' ' 36' ' ' HIS . 0.8 OUTLIER -60.46 132.12 52.89 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.312 0.577 . . . . 0.0 112.025 179.926 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.633 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.9 mmmt . . . . . 0 C--O 1.249 1.066 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.889 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.751 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 121.028 0.442 . . . . 0.0 111.806 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.4 173.6 4.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.191 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.512 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 2.1 tp -173.4 150.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.738 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.982 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.9 OUTLIER -129.47 130.66 46.15 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.463 178.689 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.52 ' CD1' HG21 ' A' ' 30' ' ' ILE . 5.4 pt -144.47 176.66 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.432 ' O ' ' HB2' ' A' ' 27' ' ' SER . 76.4 t-105 -103.05 98.4 8.35 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.618 ' CD1' HG23 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -125.55 126.98 45.68 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 175.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' B' ' 12' ' ' LEU . 2.3 t -81.87 -150.46 0.08 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.141 -0.624 . . . . 0.0 109.496 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -87.56 -163.56 0.96 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . 0.413 ' O ' ' HB ' ' B' ' 11' ' ' THR . 2.2 tt0 35.77 39.14 0.06 Allowed 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.448 0.699 . . . . 0.0 112.309 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.685 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 1.9 t -176.57 -52.36 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.671 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.584 HD13 ' CG ' ' B' ' 13' ' ' GLU . 0.1 OUTLIER -67.93 -33.15 74.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.266 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.584 ' CG ' HD13 ' B' ' 12' ' ' LEU . 29.6 mt-10 -96.41 -37.64 10.37 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.062 -1.426 . . . . 0.0 109.271 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.685 ' HB2' ' N ' ' B' ' 11' ' ' THR . 1.5 m-20 -56.7 -34.54 67.53 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.666 -178.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.774 ' CD2' ' HG2' ' B' ' 29' ' ' MET . 0.0 OUTLIER -71.58 -5.02 30.28 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.512 ' N ' HD21 ' B' ' 15' ' ' LEU . 10.9 mm-40 -60.11 -46.95 87.91 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.334 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -55.56 -35.59 65.9 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.101 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.501 ' CE ' ' HB2' ' B' ' 15' ' ' LEU . 34.8 mtm -69.57 -59.8 2.73 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.105 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.768 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -36.41 -46.88 0.58 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.463 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 1.5 mmm-85 -67.7 -73.73 0.13 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -50.86 -29.99 13.32 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.59 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.451 ' HG3' ' HB3' ' B' ' 18' ' ' MET . 25.0 mm-40 -79.29 -27.65 42.24 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.688 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 94.58 67.17 1.02 Allowed Glycine 0 C--N 1.341 0.83 0 C-N-CA 120.263 -0.97 . . . . 0.0 113.587 178.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.768 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 177.86 -176.74 0.19 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.099 0.476 . . . . 0.0 111.554 178.038 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' SER . . . . . 0.445 ' N ' HD21 ' B' ' 24' ' ' LEU . 3.5 t -115.79 176.4 5.1 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.125 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.501 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.9 mttm -41.44 -39.53 1.53 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.588 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 26.6 p -73.3 -63.77 1.12 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.664 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.8 mm-40 -59.19 -18.6 37.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.79 ' HE2' ' CG2' ' B' ' 32' ' ' VAL . 1.1 tpt -74.55 -48.08 28.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 123.793 1.758 . . . . 0.0 107.494 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.501 ' HB ' ' O ' ' B' ' 26' ' ' LYS . 0.5 OUTLIER -65.79 -23.26 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.82 0 CA-C-N 112.79 -2.005 . . . . 0.0 112.062 -178.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -85.17 -44.74 12.68 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.741 176.779 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.79 ' CG2' ' HE2' ' B' ' 29' ' ' MET . 4.4 m -52.39 -34.59 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-O 121.969 0.89 . . . . 0.0 109.211 178.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.884 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -37.72 -45.33 0.79 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.065 -1.879 . . . . 0.0 111.734 178.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.651 HD13 HD21 ' A' ' 15' ' ' LEU . 8.5 mt -83.01 -32.29 27.0 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.638 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -21.18 60.18 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.884 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 8.0 p-80 -105.71 -27.84 11.07 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.686 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 12.5 t80 -52.06 149.21 5.33 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.003 0.365 . . . . 0.0 110.067 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.564 ' HD3' ' CE2' ' B' ' 37' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 123.342 0.657 . . . . 0.0 112.455 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.794 ' HD2' HD22 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.727 0.299 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -70.91 128.5 36.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 110.301 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.481 HD22 HD11 ' A' ' 5' ' ' ILE . 2.3 tp -123.93 135.75 53.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.609 -178.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 1.01 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -131.84 123.55 27.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.156 179.33 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.65 HD11 HG21 ' B' ' 30' ' ' ILE . 0.1 OUTLIER -152.64 -173.79 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.096 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -91.82 92.21 8.28 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -177.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.609 ' CD1' HG23 ' B' ' 30' ' ' ILE . 2.0 mm? -129.56 103.37 6.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.606 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 28.4 p -66.3 -142.71 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 120.87 0.367 . . . . 0.0 111.515 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -97.46 -147.4 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.065 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.502 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.8 tt0 32.42 45.75 0.06 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.483 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.808 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.6 OUTLIER -172.53 -51.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.694 179.166 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.572 HD23 HD21 ' B' ' 3' ' ' LEU . 17.1 mt -72.19 -41.47 66.92 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -81.15 -38.79 26.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.59 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.808 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -42.83 -28.52 0.25 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-N 114.538 -1.21 . . . . 0.0 111.081 179.209 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.784 ' HG ' ' HG2' ' A' ' 29' ' ' MET . 0.1 OUTLIER -65.24 9.0 0.12 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -53.56 -41.03 66.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -87.26 -24.63 24.3 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.689 ' HB2' ' CD1' ' A' ' 15' ' ' LEU . 4.1 mtm -97.75 -65.85 0.94 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.826 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -33.9 -31.38 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -64.99 -108.22 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 119.524 -0.87 . . . . 0.0 110.743 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -24.35 59.06 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 18' ' ' MET . 22.0 mm-40 -107.42 -21.59 12.87 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -176.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.826 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -128.52 21.27 5.42 Favored Glycine 0 CA--C 1.507 -0.46 0 C-N-CA 117.17 -2.443 . . . . 0.0 116.831 -176.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.626 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER 51.0 -157.71 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 118.909 1.354 . . . . 0.0 113.192 175.223 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.457 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.1 p -62.51 159.34 15.91 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.341 -1.3 . . . . 0.0 109.468 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.46 -42.31 6.97 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.505 ' HA ' HD13 ' B' ' 5' ' ' ILE . 28.7 p -80.88 -40.97 23.87 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.626 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mm-40 -61.82 -28.39 69.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.125 -0.23 . . . . 0.0 110.757 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.784 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -67.11 -42.38 84.62 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-O 122.512 1.148 . . . . 0.0 108.567 177.586 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.651 HG21 ' CD1' ' B' ' 7' ' ' LEU . 0.3 OUTLIER -76.77 -35.04 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.365 0 CA-C-N 112.725 -2.034 . . . . 0.0 113.473 -175.474 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.461 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -63.97 -46.85 82.83 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.517 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -58.7 -41.27 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 CA-C-N 112.635 -2.075 . . . . 0.0 111.425 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.771 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -45.42 -41.16 8.95 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.696 -1.138 . . . . 0.0 112.119 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.657 HD11 ' CD1' ' B' ' 15' ' ' LEU . 7.0 mt -81.47 -29.87 33.57 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.961 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -71.67 -17.51 62.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 33.2 m80 -118.23 39.61 3.38 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.596 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 58.1 t80 -90.01 162.81 15.19 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.374 -178.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.557 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.271 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.606 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.978 0.418 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -75.82 138.45 41.16 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.963 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.572 HD21 HD23 ' A' ' 12' ' ' LEU . 2.2 tp -128.33 133.13 48.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.469 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 1.01 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -126.19 123.78 38.99 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.776 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.538 HG13 ' CD2' ' B' ' 7' ' ' LEU . 1.6 pt -154.29 175.69 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.437 ' O ' HD11 ' B' ' 7' ' ' LEU . 75.3 t-105 -88.57 96.13 10.51 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.651 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.1 mm? -119.5 118.93 32.39 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.578 ' C ' HD23 ' B' ' 12' ' ' LEU . 44.9 p -65.7 164.97 13.41 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.995 0.903 . . . . 0.0 111.165 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.658 ' HA ' HD23 ' B' ' 12' ' ' LEU . 8.3 t70 -64.45 -37.9 89.16 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 113.633 -1.621 . . . . 0.0 112.924 -177.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -73.16 38.75 0.09 Allowed 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.78 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 7.9 t -174.17 -51.54 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.975 0.51 . . . . 0.0 111.877 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.794 HD22 ' HD2' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -57.54 -28.61 63.68 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 176.674 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 68.7 mm-40 -84.23 -38.9 19.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.393 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.78 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.2 t70 -44.14 -29.58 0.64 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.829 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.802 HD12 HG12 ' B' ' 30' ' ' ILE . 28.9 mt -79.4 27.07 0.27 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.1 OUTLIER -111.46 -52.18 2.8 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.247 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -76.93 -32.68 57.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 120.835 0.35 . . . . 0.0 110.597 178.812 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.449 ' HE2' ' CG ' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -97.25 20.64 11.14 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.111 179.32 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.849 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -100.03 -19.79 16.36 Favored 'General case' 0 C--O 1.214 -0.779 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 39.1 mmm-85 -65.67 -126.35 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.726 0 O-C-N 121.657 -0.652 . . . . 0.0 110.468 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -52.69 -22.85 5.64 Favored 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 121.681 -0.637 . . . . 0.0 110.439 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -93.64 -23.43 18.27 Favored 'General case' 0 CA--C 1.522 -0.127 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.849 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -134.99 16.28 4.22 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 117.19 -2.433 . . . . 0.0 116.369 -177.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' B' ' 19' ' ' ALA . 1.0 OUTLIER 55.56 -166.18 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.653 1.226 . . . . 0.0 113.667 175.846 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.1 m -53.94 149.56 8.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.145 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -41.8 -46.44 3.9 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.427 ' HA ' HD13 ' A' ' 5' ' ' ILE . 74.5 p -75.87 -44.13 42.19 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.652 0.263 . . . . 0.0 110.702 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.541 ' O ' HG23 ' B' ' 32' ' ' VAL . 3.6 mt-10 -54.78 -38.68 67.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.74 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.75 ' HE1' ' CG2' ' B' ' 32' ' ' VAL . 4.0 tpt -57.89 -47.21 83.45 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 123.623 1.678 . . . . 0.0 108.935 177.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.802 HG12 HD12 ' B' ' 15' ' ' LEU . 0.3 OUTLIER -65.9 -21.45 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.667 0 CA-C-N 112.972 -1.922 . . . . 0.0 112.649 -178.099 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.404 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -83.53 -46.36 12.52 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 177.49 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.75 ' CG2' ' HE1' ' B' ' 29' ' ' MET . 0.0 OUTLIER -58.66 -30.3 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.062 0 CA-C-O 121.878 0.847 . . . . 0.0 109.009 177.833 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.975 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.15 -54.71 1.73 Allowed 'General case' 0 CA--C 1.495 -1.14 0 CA-C-N 113.599 -1.637 . . . . 0.0 108.729 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.612 ' CD1' ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -67.44 -46.72 72.26 Favored 'General case' 0 N--CA 1.399 -2.976 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.243 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . 0.612 ' N ' ' CD1' ' B' ' 34' ' ' LEU . 4.6 mt-30 -64.21 -59.33 4.55 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.975 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.3 p80 -65.87 -16.41 63.81 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.771 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.8 OUTLIER -55.83 137.69 49.62 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.577 0.351 . . . . 0.0 110.298 178.682 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.48 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.067 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.775 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.775 0.322 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.471 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.5 m95 -78.95 165.76 23.12 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.427 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 tp -171.34 147.29 2.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.238 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.99 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -108.57 140.32 42.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.658 ' CD1' HG22 ' B' ' 30' ' ' ILE . 3.8 pt -147.92 176.64 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.687 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 76.6 t-105 -100.86 100.77 11.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.498 ' O ' ' HB2' ' B' ' 1' ' ' ARG . 0.7 OUTLIER -131.18 114.62 15.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.712 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -88.54 -167.11 1.78 Allowed 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.422 0.63 . . . . 0.0 112.303 -178.209 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -50.85 -57.99 7.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.784 -1.098 . . . . 0.0 112.419 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.25 -29.55 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.587 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 69.8 p -95.26 -33.39 12.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 8' ' ' SER . 69.9 mt -67.94 -40.69 83.23 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 178.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -59.98 -43.91 94.81 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.749 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.587 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -57.06 -51.62 68.53 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.395 -1.275 . . . . 0.0 109.564 178.236 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.619 ' CD1' HG12 ' A' ' 30' ' ' ILE . 14.8 mt -78.15 24.56 0.25 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.87 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.419 ' CG ' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -114.99 -52.96 2.67 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 178.454 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.419 ' N ' ' CG ' ' A' ' 16' ' ' GLU . 0.8 OUTLIER -87.49 -32.82 19.25 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 122.667 0.387 . . . . 0.0 110.782 178.522 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.6 ' CE ' ' HB2' ' B' ' 34' ' ' LEU . 0.5 OUTLIER -91.73 6.04 47.49 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.46 179.619 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.841 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -97.21 -15.53 20.81 Favored 'General case' 0 C--O 1.211 -0.928 0 C-N-CA 122.669 0.388 . . . . 0.0 111.737 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.404 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -68.35 -124.55 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.785 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 tpp85 -52.29 -25.13 8.7 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 118.606 0.639 . . . . 0.0 110.296 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -92.04 -20.05 21.72 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 114.498 1.295 . . . . 0.0 114.498 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.841 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -142.58 19.56 2.41 Favored Glycine 0 CA--C 1.504 -0.612 0 C-N-CA 116.64 -2.695 . . . . 0.0 116.564 -177.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.694 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER 50.73 -161.52 0.07 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.879 1.339 . . . . 0.0 113.54 175.624 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.479 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.8 p -60.48 156.78 15.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.666 178.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.55 -40.15 2.56 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.3 m -79.68 -49.36 12.21 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.247 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.694 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 3.2 mm-40 -55.49 -30.41 60.57 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.387 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.597 ' O ' ' CE ' ' A' ' 29' ' ' MET . 3.6 tpt -61.01 -50.84 71.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.069 1.414 . . . . 0.0 108.767 177.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.619 HG12 ' CD1' ' A' ' 15' ' ' LEU . 0.4 OUTLIER -71.81 -34.66 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.523 0 CA-C-N 112.929 -1.941 . . . . 0.0 114.133 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.25 -47.98 72.0 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.872 0.844 . . . . 0.0 109.092 177.284 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.671 HG23 HD13 ' A' ' 24' ' ' LEU . 0.9 OUTLIER -59.12 -39.43 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-N 113.684 -1.598 . . . . 0.0 111.445 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.692 ' HB1' ' HB3' ' B' ' 34' ' ' LEU . . . -47.56 -40.37 18.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.063 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.513 HD13 ' CD2' ' B' ' 15' ' ' LEU . 11.9 mt -78.51 -28.47 46.25 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.364 -177.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.23 -18.83 57.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.413 ' HD1' HG11 ' A' ' 32' ' ' VAL . 57.6 m80 -104.75 -38.79 6.56 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.585 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 24.6 t80 -44.32 153.6 0.15 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.954 0.407 . . . . 0.0 111.966 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.522 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 9.3 mmmt . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.493 -0.765 . . . . 0.0 111.364 177.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.712 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.2 mpt_? . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.194 0.521 . . . . 0.0 111.861 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 74.4 m95 -114.66 105.04 12.59 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.5 tp -126.49 146.57 50.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.819 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.99 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -106.01 136.73 45.15 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.921 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.602 ' CD1' HG23 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -148.41 -177.57 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.403 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -92.28 90.13 7.14 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.599 HD12 ' CG2' ' A' ' 30' ' ' ILE . 0.3 OUTLIER -127.01 94.41 4.02 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.775 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 42.6 p -64.58 177.54 0.89 Allowed 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.79 0.805 . . . . 0.0 112.342 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -52.87 -50.07 64.54 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.196 -1.365 . . . . 0.0 111.67 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.0 -26.55 6.18 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.624 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 26.1 p -92.45 -25.65 18.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' B' ' 8' ' ' SER . 22.7 mt -77.88 -40.71 39.12 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.72 -40.95 89.7 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 113.957 -1.474 . . . . 0.0 107.233 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.542 ' O ' ' HG3' ' B' ' 18' ' ' MET . 41.8 t0 -54.82 -39.22 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 114.016 -1.447 . . . . 0.0 110.276 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.709 HD22 ' SD ' ' B' ' 29' ' ' MET . 32.1 mt -76.96 27.72 0.14 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 47.4 mt-10 -99.82 -54.46 2.9 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -77.48 -22.0 51.97 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.51 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.859 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 11.3 mtm -91.29 -24.21 19.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.944 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.686 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.32 -66.51 0.91 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -54.7 -67.82 0.24 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -179.419 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -31.44 11.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.405 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.508 ' HB2' ' O ' ' B' ' 18' ' ' MET . 15.9 mm-40 -87.95 -9.94 52.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.261 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.26 -3.39 86.25 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.855 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.686 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 87.3 mt -75.74 172.65 12.28 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.532 0.682 . . . . 0.0 111.6 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.4 p -115.47 163.4 15.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 mttm -42.16 -41.56 2.71 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.687 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 4.3 m -84.77 -50.5 7.53 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.611 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.5 mt-10 -64.49 -7.98 12.07 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.732 0.301 . . . . 0.0 110.245 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.859 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.0 tpt -85.37 -47.15 10.27 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 122.639 1.209 . . . . 0.0 108.028 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.658 HG22 ' CD1' ' A' ' 5' ' ' ILE . 0.4 OUTLIER -75.86 -40.96 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 112.971 -1.922 . . . . 0.0 113.141 -177.436 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -44.76 95.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.972 0.891 . . . . 0.0 109.658 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.611 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -70.49 -32.86 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 113.714 -1.585 . . . . 0.0 112.545 -179.208 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.585 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -54.7 -53.14 58.87 Favored 'General case' 0 CA--C 1.501 -0.916 0 CA-C-O 121.889 0.852 . . . . 0.0 110.163 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.692 ' HB3' ' HB1' ' A' ' 33' ' ' ALA . 4.0 pp -72.27 -25.52 61.63 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.744 -1.571 . . . . 0.0 112.033 -178.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -19.75 65.78 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 55.0 m80 -116.27 24.37 11.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 175.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -95.87 143.96 26.63 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.323 0.649 . . . . 0.0 110.124 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.441 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.724 -0.655 . . . . 0.0 112.225 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.719 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.071 0.462 . . . . 0.0 111.881 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -112.3 111.04 21.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.263 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -127.3 144.08 51.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.362 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.984 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -109.9 136.65 48.86 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.434 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.577 HG13 HD21 ' A' ' 7' ' ' LEU . 1.8 pt -150.08 176.82 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -93.61 90.91 6.82 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -177.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.577 HD21 HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -124.64 104.14 8.52 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.519 ' HA ' ' HB2' ' B' ' 1' ' ' ARG . 6.9 t -78.77 -139.1 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -80.59 -160.09 0.28 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.258 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.415 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.9 tt0 35.07 45.07 0.16 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-O 121.538 0.685 . . . . 0.0 111.667 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.774 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.65 -52.33 0.02 OUTLIER 'General case' 0 C--O 1.23 0.079 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.893 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 8' ' ' SER . 18.1 mt -73.93 -42.09 61.11 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -76.44 -39.37 53.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 113.125 -1.852 . . . . 0.0 108.207 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.774 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -45.16 -38.69 5.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.302 178.896 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.765 HD23 HD21 ' B' ' 34' ' ' LEU . 3.0 mm? -68.68 7.01 0.72 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.51 ' HG3' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -62.42 -39.81 94.51 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.51 ' N ' ' HG3' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -102.09 -10.85 19.32 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.62 ' HB2' HD13 ' A' ' 15' ' ' LEU . 29.4 mtm -97.91 -66.11 0.92 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.838 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -36.87 -29.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.477 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 20.8 mmm-85 -64.69 -109.76 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.437 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -25.07 64.53 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.676 0.274 . . . . 0.0 111.692 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 18' ' ' MET . 22.8 mm-40 -105.48 -11.13 16.54 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -177.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.838 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -138.97 17.66 3.19 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 116.553 -2.737 . . . . 0.0 116.63 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.486 ' N ' ' O ' ' A' ' 19' ' ' ALA . 0.8 OUTLIER 49.91 -157.61 0.09 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 119.054 1.427 . . . . 0.0 112.739 175.56 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -61.14 160.27 10.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.269 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.22 -39.29 13.79 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.621 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 69.5 m -79.04 -44.55 21.96 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.72 0.266 . . . . 0.0 111.72 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.466 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 9.8 mm-40 -61.72 -31.31 71.47 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.907 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.745 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.26 -38.8 92.34 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.771 1.272 . . . . 0.0 107.77 177.029 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.68 HG22 HD13 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -76.18 -17.98 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.97 0 CA-C-N 112.744 -2.025 . . . . 0.0 113.569 -176.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.532 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -73.18 -51.97 15.86 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.115 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.532 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 7.3 p -65.95 -28.46 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.441 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.763 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -41.97 -42.44 2.81 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.811 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.604 HD12 HD22 ' B' ' 15' ' ' LEU . 9.0 mt -84.49 -27.7 27.25 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.157 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.401 ' HB2' ' HA ' ' A' ' 32' ' ' VAL . 31.2 mt-30 -63.53 -32.58 74.08 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.763 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 14.0 p-80 -97.91 -38.11 9.54 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.339 0.518 . . . . 0.0 112.178 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.564 ' CG ' ' HA ' ' B' ' 33' ' ' ALA . 21.4 t80 -45.87 141.18 3.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.427 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.129 0 C-N-CA 123.678 0.791 . . . . 0.0 112.269 178.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.519 ' HB2' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 120.725 0.298 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -100.28 114.16 27.42 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.452 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 tp -133.07 145.4 50.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.643 -178.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.984 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -111.6 136.34 50.94 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.68 HD13 HG22 ' A' ' 30' ' ' ILE . 1.5 pt -147.04 -176.89 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.621 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 71.0 t-105 -98.69 98.49 9.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.53 HD12 ' CG2' ' A' ' 30' ' ' ILE . 0.8 OUTLIER -131.14 108.8 9.99 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.575 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.719 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -92.52 -164.96 1.25 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.436 0.636 . . . . 0.0 112.053 -178.225 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -45.15 -62.57 1.2 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.513 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -50.79 -29.75 12.39 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.547 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 68.6 p -88.46 -34.74 17.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' B' ' 8' ' ' SER . 45.0 mt -69.95 -40.01 75.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -61.95 -41.92 98.53 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.783 -1.553 . . . . 0.0 107.736 175.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.547 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.4 OUTLIER -53.35 -49.43 67.15 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.003 178.516 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.73 HD23 ' CG ' ' B' ' 29' ' ' MET . 17.9 mt -73.76 8.38 1.97 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.74 -40.1 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.72 -26.59 29.62 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.796 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.0 mtm -86.23 -64.43 1.15 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.752 -0.204 . . . . 0.0 111.4 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.633 ' HB3' ' HB2' ' B' ' 29' ' ' MET . . . -47.89 -43.94 29.12 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.683 0.393 . . . . 0.0 111.871 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.443 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 24.0 mmm-85 -61.01 -68.76 0.28 Allowed 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 111.597 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -31.64 37.25 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.95 179.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.457 ' HB3' ' HG ' ' B' ' 24' ' ' LEU . 20.7 mm-40 -86.51 -10.47 54.04 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.289 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.15 14.22 68.21 Favored Glycine 0 C--N 1.341 0.809 0 C-N-CA 120.499 -0.858 . . . . 0.0 111.582 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.576 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 90.5 mt -86.8 166.77 14.97 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.56 0.695 . . . . 0.0 111.844 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 83.7 p -103.44 164.34 11.71 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.355 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -43.54 -35.98 1.89 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -179.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.482 ' HA ' HD11 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -85.59 -56.63 3.41 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.254 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.1 mt-10 -58.89 -15.34 12.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.612 0.244 . . . . 0.0 110.386 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.796 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.7 tpt -79.29 -48.1 14.72 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 122.6 1.19 . . . . 0.0 108.227 177.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.508 HG12 ' CD1' ' B' ' 15' ' ' LEU . 0.4 OUTLIER -75.58 -33.89 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.037 0 CA-C-N 113.191 -1.822 . . . . 0.0 113.436 -177.36 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.544 ' O ' HD13 ' B' ' 34' ' ' LEU . 0.0 OUTLIER -67.65 -45.93 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.798 0.809 . . . . 0.0 109.933 178.291 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.547 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.0 OUTLIER -66.77 -37.43 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 114.277 -1.329 . . . . 0.0 112.192 -178.916 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.564 ' HA ' ' CG ' ' A' ' 37' ' ' TYR . . . -61.26 -47.54 85.55 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 122.031 0.92 . . . . 0.0 109.662 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.765 HD21 HD23 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -68.98 -42.8 76.07 Favored 'General case' 0 N--CA 1.401 -2.881 0 CA-C-N 113.34 -1.755 . . . . 0.0 111.121 -177.908 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . 0.582 ' N ' ' CD1' ' B' ' 34' ' ' LEU . 4.6 mt-30 -64.3 -19.32 65.34 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -94.29 27.29 2.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.179 0.514 . . . . 0.0 109.647 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.688 ' CD1' ' CE1' ' A' ' 36' ' ' HIS . 7.9 t80 -103.16 156.02 18.0 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.494 -178.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.426 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.06 0 C-N-CA 124.449 1.1 . . . . 0.0 112.334 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.607 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 3.6 ttt85 . . . . . 0 N--CA 1.486 1.353 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -78.26 124.79 28.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.501 HD23 HD22 ' B' ' 12' ' ' LEU . 2.0 tp -138.61 141.03 39.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.308 -178.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.998 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -106.3 136.53 45.86 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 178.286 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.681 ' CD1' HG23 ' B' ' 30' ' ' ILE . 4.9 pt -146.95 175.5 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 27' ' ' SER . 75.0 t-105 -98.78 109.17 21.97 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -177.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.51 ' CD1' ' CG2' ' B' ' 30' ' ' ILE . 0.9 OUTLIER -131.26 117.18 18.63 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.536 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 14.9 p -82.86 178.02 8.37 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 121.783 0.802 . . . . 0.0 111.969 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -53.88 -50.43 66.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.962 -1.472 . . . . 0.0 111.788 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.3 -35.9 3.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.229 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.798 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -101.01 -15.97 17.29 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 8' ' ' SER . 78.8 mt -69.58 -38.96 77.57 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 105.474 -2.047 . . . . 0.0 105.474 175.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -61.16 -41.09 96.14 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 113.226 -1.806 . . . . 0.0 107.502 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.798 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -53.58 -48.42 69.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.028 178.075 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.701 HD13 HG12 ' A' ' 30' ' ' ILE . 19.2 mt -80.41 16.07 1.43 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.478 -0.783 . . . . 0.0 113.099 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.519 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -100.41 -44.69 5.82 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.632 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.519 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 7.2 mttm -88.75 -38.74 14.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.703 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.494 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 46.8 mtm -66.28 -70.6 0.23 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.497 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.778 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -27.7 -32.1 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 125.081 1.352 . . . . 0.0 114.161 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.469 ' N ' ' O ' ' A' ' 18' ' ' MET . 1.5 mtt-85 -66.14 -120.71 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.08 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -23.3 12.51 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.924 -0.485 . . . . 0.0 111.673 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.441 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 17.0 mt-10 -108.37 -7.08 15.95 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 115.632 1.716 . . . . 0.0 115.632 -177.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.778 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -143.46 18.49 2.26 Favored Glycine 0 CA--C 1.504 -0.621 0 C-N-CA 116.075 -2.964 . . . . 0.0 117.262 -176.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.585 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER 53.46 -159.52 0.14 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 119.54 1.67 . . . . 0.0 113.0 175.781 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.454 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 14.8 p -66.22 158.92 27.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.635 -1.166 . . . . 0.0 109.852 178.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.52 -38.73 4.35 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.9 m -79.51 -52.65 7.75 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 122.089 0.156 . . . . 0.0 111.072 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.585 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -57.26 -27.39 62.05 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.26 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.539 ' O ' ' CE ' ' A' ' 29' ' ' MET . 3.3 tpt -64.53 -47.83 77.38 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 122.973 1.368 . . . . 0.0 108.824 177.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.701 HG12 HD13 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -75.57 -27.83 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.499 0 CA-C-N 112.671 -2.059 . . . . 0.0 114.268 -176.389 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.482 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -73.36 -52.01 15.35 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.812 0.815 . . . . 0.0 109.277 177.039 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -55.22 -40.18 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-N 113.75 -1.568 . . . . 0.0 111.077 -179.516 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.669 ' CB ' HD21 ' B' ' 34' ' ' LEU . . . -50.34 -40.42 49.11 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.61 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.617 HD22 HG12 ' B' ' 30' ' ' ILE . 12.1 mt -74.92 -35.49 62.19 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.256 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -74.41 -11.1 60.15 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.5 m80 -106.61 -46.86 3.89 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 117.089 -0.05 . . . . 0.0 110.967 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.718 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 12.0 t80 -41.65 147.68 0.18 Allowed 'General case' 0 CA--C 1.541 0.607 0 O-C-N 123.275 0.359 . . . . 0.0 111.836 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.523 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 6.0 tppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.171 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -95.33 105.81 17.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -121.45 142.87 49.61 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.957 -178.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.998 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -108.29 137.47 46.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 177.836 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.587 HD11 HD22 ' B' ' 7' ' ' LEU . 2.4 pp -151.59 167.88 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 121.179 0.514 . . . . 0.0 112.374 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -83.63 94.48 8.11 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.925 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.588 HD11 HG21 ' A' ' 30' ' ' ILE . 0.9 OUTLIER -129.29 99.89 5.39 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.216 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.607 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 52.3 p -72.66 -135.86 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.353 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.19 -151.7 0.27 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.891 -0.141 . . . . 0.0 111.295 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 33.92 43.62 0.07 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.502 0.721 . . . . 0.0 112.634 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.679 ' CA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -173.24 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.705 179.189 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.541 ' N ' HG22 ' B' ' 11' ' ' THR . 22.8 mt -76.55 -42.0 44.57 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.44 -41.21 40.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.483 -1.689 . . . . 0.0 108.293 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.679 ' HB2' ' CA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.28 -17.37 1.74 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.424 179.008 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.743 ' CD1' ' HB2' ' B' ' 18' ' ' MET . 0.2 OUTLIER -71.59 21.04 0.05 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -179.683 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.17 -56.8 12.2 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 122.251 -0.281 . . . . 0.0 111.155 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.619 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 4.6 mtpm? -91.83 -2.05 57.06 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.743 ' HB2' ' CD1' ' B' ' 15' ' ' LEU . 3.9 mtm -96.99 -32.79 11.83 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.841 ' HA ' HD22 ' B' ' 24' ' ' LEU . . . -99.33 -73.3 0.63 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.468 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 0.2 OUTLIER -55.97 -62.41 1.72 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.556 0.694 . . . . 0.0 111.47 -179.371 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . 0.619 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.01 -28.0 3.63 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.708 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.771 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -87.97 -30.72 19.82 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.014 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.97 -7.48 31.22 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.886 -0.673 . . . . 0.0 114.519 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.853 ' C ' HD21 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -93.9 -174.02 3.31 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.096 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 96.4 p -103.97 164.2 11.86 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.099 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.1 OUTLIER -45.58 -40.47 8.84 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.279 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.58 ' HB2' ' HB3' ' A' ' 6' ' ' TRP . 59.8 p -81.43 -50.5 9.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.416 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.7 mm-40 -59.29 -20.1 51.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.72 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.673 ' C ' ' SD ' ' B' ' 29' ' ' MET . 0.0 OUTLIER -72.22 -39.85 68.23 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 122.629 1.204 . . . . 0.0 108.63 177.469 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.681 HG23 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -77.88 -38.09 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.482 0 CA-C-N 112.636 -2.074 . . . . 0.0 113.262 -175.494 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.427 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -60.8 -44.56 96.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 122.671 1.224 . . . . 0.0 107.815 175.755 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.427 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -59.97 -44.94 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 CA-C-N 112.271 -2.24 . . . . 0.0 111.872 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.718 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -51.8 -33.63 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.294 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.669 HD21 ' CB ' ' A' ' 33' ' ' ALA . 15.6 mt -76.4 -32.96 58.84 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.442 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -79.41 -16.72 55.71 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -123.73 21.18 9.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.17 0.441 . . . . 0.0 111.324 176.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.57 131.57 37.91 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.793 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.452 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.722 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.814 ' HD3' HD23 ' B' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.167 0.508 . . . . 0.0 112.104 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -92.02 120.58 32.79 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.55 ' HB3' HD22 ' B' ' 7' ' ' LEU . 2.8 tp -117.45 142.26 47.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -130.53 125.61 34.72 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.93 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' B' ' 27' ' ' SER . 2.1 pt -152.02 -178.92 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.5 t-105 -94.72 98.38 10.74 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -177.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.686 HD11 HG21 ' B' ' 30' ' ' ILE . 1.5 mm? -125.09 111.34 15.23 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 29.5 t -76.8 -125.07 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.577 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 8.9 t70 -95.9 -45.47 6.93 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -68.43 45.41 0.04 OUTLIER 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.187 0.595 . . . . 0.0 112.005 -178.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.782 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.5 t -170.62 -42.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.426 ' N ' HG23 ' A' ' 11' ' ' THR . 31.4 mt -72.66 -39.82 66.81 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.577 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 0.2 OUTLIER -68.7 -39.58 80.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 113.511 -1.677 . . . . 0.0 107.033 176.01 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.782 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -48.3 -37.93 17.64 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.097 -1.411 . . . . 0.0 109.203 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.679 HD13 HG12 ' A' ' 30' ' ' ILE . 42.4 mt -84.86 33.39 0.53 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.811 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -107.55 -58.03 2.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.03 -33.47 61.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.734 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.471 ' HG2' ' HG3' ' B' ' 38' ' ' LYS . 33.4 mtm -74.84 -67.42 0.64 Allowed 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.019 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.793 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -28.87 -31.57 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.857 1.263 . . . . 0.0 114.121 -178.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' A' ' 18' ' ' MET . 3.7 mtt-85 -66.78 -118.23 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.151 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.086 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.58 -22.87 24.08 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 122.003 -0.435 . . . . 0.0 111.778 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.508 ' HG3' ' HD3' ' B' ' 38' ' ' LYS . 24.3 mm-40 -109.3 -5.8 15.74 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -177.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.793 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -144.49 16.96 2.05 Favored Glycine 0 C--O 1.221 -0.701 0 C-N-CA 116.274 -2.87 . . . . 0.0 117.183 -176.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.515 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER 53.04 -161.83 0.11 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 119.496 1.648 . . . . 0.0 113.38 175.925 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -59.89 166.73 2.52 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.97 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.419 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -57.63 -42.68 83.87 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.98 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 94.2 p -74.24 -46.11 43.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.711 0.291 . . . . 0.0 110.273 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.515 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.5 mt-10 -61.08 -35.23 76.43 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.777 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.677 ' HE2' ' CG2' ' A' ' 32' ' ' VAL . 3.3 tpt -62.4 -47.95 81.88 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 123.64 1.686 . . . . 0.0 108.687 177.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.736 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -67.86 -15.68 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.979 0 CA-C-N 112.876 -1.965 . . . . 0.0 112.876 -177.572 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -83.3 -46.49 12.56 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.002 176.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.767 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -60.59 -34.86 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.978 0 CA-C-O 121.596 0.712 . . . . 0.0 109.217 177.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.918 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.28 -46.76 0.55 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.814 -1.539 . . . . 0.0 111.057 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.599 HD11 HD23 ' B' ' 15' ' ' LEU . 6.3 mt -87.26 -29.72 21.45 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.184 -178.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -83.64 -15.65 48.14 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.918 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -114.64 -4.46 12.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 -179.499 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.661 ' CD2' ' HD3' ' A' ' 38' ' ' LYS . 4.4 t80 -69.03 157.42 36.83 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.661 ' HD3' ' CD2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.181 0 C-N-CA 124.752 1.221 . . . . 0.0 112.899 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.375 0.131 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -81.43 121.52 26.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.5 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.68 140.55 50.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.469 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.84 129.86 56.34 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.736 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.4 pp -156.6 174.41 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.8 t-105 -91.76 116.11 28.62 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.586 ' O ' HD22 ' B' ' 12' ' ' LEU . 0.6 OUTLIER -129.03 127.91 42.56 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 177.184 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 7.9 p -82.13 -178.33 6.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 121.831 0.825 . . . . 0.0 111.1 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.57 ' HA ' HD21 ' B' ' 12' ' ' LEU . 11.2 t70 -58.36 -44.99 89.06 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.309 -1.314 . . . . 0.0 113.172 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -75.68 40.53 0.19 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.089 0.471 . . . . 0.0 111.939 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.701 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 10.7 t -173.6 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.671 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.814 HD23 ' HD3' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -61.18 -30.12 70.21 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.048 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.501 ' HG2' ' HG ' ' B' ' 12' ' ' LEU . 2.5 mm-40 -99.52 -36.07 9.67 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.974 -1.466 . . . . 0.0 109.584 177.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.701 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -42.91 -33.41 0.78 Allowed 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.881 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.73 HD13 HG12 ' B' ' 30' ' ' ILE . 49.1 mt -66.74 12.38 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -75.22 -52.47 10.83 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -93.76 -10.15 35.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.692 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.61 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 11.6 mtp -87.11 -21.28 26.11 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.682 0.277 . . . . 0.0 110.966 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.801 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.35 -67.93 0.82 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.826 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.8 mmm180 -58.93 -70.28 0.16 Allowed 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.57 -33.6 6.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.796 -179.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.61 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 3.8 mm-40 -82.2 -25.41 34.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.291 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.468 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 98.6 64.38 0.86 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.439 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.801 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 179.21 178.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.209 0.528 . . . . 0.0 111.634 177.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' SER . . . . . 0.474 ' N ' HD22 ' B' ' 24' ' ' LEU . 0.8 OUTLIER -105.2 169.08 8.65 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.71 -178.521 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.89 -41.3 11.17 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.543 ' HA ' HD12 ' A' ' 5' ' ' ILE . 1.7 p -78.09 -50.65 11.62 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.445 0.164 . . . . 0.0 110.986 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.564 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.1 mm-40 -65.52 -10.6 36.23 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.412 178.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.649 ' HB2' HD21 ' B' ' 24' ' ' LEU . 2.9 tpt -84.34 -48.45 9.69 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 122.689 1.233 . . . . 0.0 107.788 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.73 HG12 HD13 ' B' ' 15' ' ' LEU . 0.6 OUTLIER -74.13 -34.91 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.95 0 CA-C-N 113.017 -1.901 . . . . 0.0 112.952 -177.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.436 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -65.91 -48.24 72.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 122.384 1.088 . . . . 0.0 109.032 177.386 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -58.73 -43.79 88.6 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.174 0 CA-C-N 112.865 -1.97 . . . . 0.0 111.671 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.617 ' HB1' ' HB2' ' A' ' 33' ' ' ALA . . . -47.32 -31.34 3.81 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.005 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.589 HD22 ' HB1' ' A' ' 33' ' ' ALA . 14.2 mt -91.86 -31.76 15.58 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -72.07 -15.03 62.01 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -111.23 19.81 17.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.114 0.415 . . . . 0.0 111.397 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.495 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 58.6 t80 -114.75 165.61 12.63 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.962 0.41 . . . . 0.0 111.823 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.508 ' HD3' ' HG3' ' A' ' 22' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.162 0 C-N-CA 123.869 0.868 . . . . 0.0 112.603 178.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.537 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.696 0.284 . . . . 0.0 111.695 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.41 126.6 31.06 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -125.35 137.7 54.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.684 -178.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -115.98 121.51 42.49 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.231 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.601 HG13 ' CD2' ' A' ' 7' ' ' LEU . 4.1 pt -145.86 176.3 1.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -177.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -94.02 100.83 12.89 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -177.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.601 ' CD2' HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -128.78 111.47 13.15 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 177.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.558 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 10.0 p -82.37 -176.79 6.39 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 121.724 0.774 . . . . 0.0 112.487 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -50.56 -47.78 57.72 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.474 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -47.03 -31.2 3.11 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.828 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -109.97 -15.29 14.09 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.5 mt -73.83 -41.04 62.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 105.901 -1.888 . . . . 0.0 105.901 176.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.41 -39.12 93.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.333 -1.758 . . . . 0.0 107.996 175.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.828 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -52.08 -44.68 64.47 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.558 178.78 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.628 HD11 HD11 ' B' ' 34' ' ' LEU . 19.6 mt -76.82 13.7 0.98 Allowed 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.3 mm-40 -98.9 -51.61 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 19.1 mttp -73.73 -26.1 60.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.211 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.642 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 58.8 mtm -81.71 -74.75 0.32 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.933 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.678 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.94 -43.42 3.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 122.908 0.483 . . . . 0.0 112.1 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.439 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.1 mmm180 -63.71 -69.7 0.26 Allowed 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.36 -34.32 33.49 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.879 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -82.9 -11.39 58.22 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.184 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.14 7.22 76.51 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.592 -178.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.678 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 94.9 mt -82.75 168.01 17.61 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.523 0.678 . . . . 0.0 111.305 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.6 p -108.71 164.61 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.973 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.439 ' HB3' HG22 ' B' ' 5' ' ' ILE . 2.4 mttm -46.24 -31.97 2.78 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.571 ' HA ' HD11 ' B' ' 5' ' ' ILE . 1.1 m -84.29 -59.23 2.45 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 122.178 0.191 . . . . 0.0 111.139 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.458 ' HB3' HD21 ' A' ' 24' ' ' LEU . 2.8 mm-40 -59.72 -12.64 7.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.159 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.642 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 3.0 tpt -82.29 -47.17 12.71 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.855 1.312 . . . . 0.0 107.746 177.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.556 HG23 HD12 ' B' ' 7' ' ' LEU . 0.6 OUTLIER -75.55 -32.01 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 CA-C-N 112.847 -1.978 . . . . 0.0 113.782 -177.818 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.473 ' HB2' HD11 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -69.45 -48.81 59.66 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.185 0.993 . . . . 0.0 109.345 178.011 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.405 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 1.6 t -59.22 -42.93 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.145 -1.843 . . . . 0.0 110.911 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.713 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -44.73 -41.62 6.98 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.331 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.681 ' HB3' ' HG ' ' B' ' 15' ' ' LEU . 8.2 mt -74.87 -33.98 62.16 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.836 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -70.95 -14.7 62.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.44 30.34 2.64 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.706 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -77.57 133.52 38.46 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 178.664 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.563 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 120.724 0.297 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -91.61 116.38 28.83 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 4.9 tp -116.46 139.43 50.46 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.736 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -122.95 123.47 40.99 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.239 178.662 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.59 HG13 HD23 ' B' ' 7' ' ' LEU . 1.3 pt -149.33 179.92 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 71.1 t-105 -93.15 89.47 6.47 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.59 HD23 HG13 ' B' ' 5' ' ' ILE . 1.3 mm? -128.57 100.22 5.67 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.537 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 53.2 p -57.11 170.94 0.41 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 122.119 0.962 . . . . 0.0 112.779 -177.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.55 -40.0 94.79 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.319 -178.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . 0.487 ' O ' ' HB2' ' B' ' 14' ' ' ASP . 3.5 mm-40 -66.53 9.56 0.17 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.623 ' HA ' ' HB3' ' B' ' 14' ' ' ASP . 3.0 t -145.72 19.17 1.48 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' B' ' 8' ' ' SER . 13.0 mt -107.79 -46.4 3.8 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 175.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -88.02 -26.6 22.51 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 114.492 -1.231 . . . . 0.0 108.946 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.623 ' HB3' ' HA ' ' B' ' 11' ' ' THR . 6.5 t70 -55.77 -6.43 0.21 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 113.654 -1.612 . . . . 0.0 113.165 -179.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.772 ' CD2' ' SD ' ' B' ' 29' ' ' MET . 0.0 OUTLIER -135.86 35.06 2.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 121.357 0.599 . . . . 0.0 111.407 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.442 ' HB2' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -51.22 -31.5 20.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.721 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.491 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 9.3 mtpp -62.14 -24.7 67.32 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.078 0.466 . . . . 0.0 110.794 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.754 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 8.6 mtm -86.64 -25.05 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.052 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.713 ' HB3' ' HB2' ' B' ' 29' ' ' MET . . . -100.3 -73.52 0.63 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.719 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.442 ' HD2' ' HB2' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -56.95 -65.05 0.68 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.163 0.506 . . . . 0.0 112.092 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . 0.491 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 13.0 mmp_? -50.54 -27.53 6.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.38 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.761 ' HG2' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -91.65 -23.69 19.76 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.004 179.524 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.82 -5.55 34.76 Favored Glycine 0 C--N 1.34 0.75 0 C-N-CA 121.342 -0.456 . . . . 0.0 112.405 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.761 HD13 ' HG2' ' B' ' 22' ' ' GLU . 53.5 mt -80.59 178.52 8.29 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.664 0.745 . . . . 0.0 112.017 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' B' ' 29' ' ' MET . 3.7 t -120.15 179.9 4.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.723 178.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.82 -38.56 61.47 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.403 ' HA ' HD12 ' A' ' 5' ' ' ILE . 2.3 m -86.36 -51.31 6.31 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 121.91 0.084 . . . . 0.0 111.087 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.46 ' HB3' HD23 ' B' ' 24' ' ' LEU . 1.6 mm-40 -62.88 -9.3 9.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.413 178.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.772 ' SD ' ' CD2' ' B' ' 15' ' ' LEU . 4.9 tpt -79.93 -47.79 14.46 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 123.095 1.426 . . . . 0.0 107.685 177.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.63 ' HA ' HD23 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -79.37 -28.77 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 CA-C-N 112.213 -2.267 . . . . 0.0 114.191 -176.694 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.409 HD21 ' N ' ' B' ' 32' ' ' VAL . 0.2 OUTLIER -70.06 -49.38 51.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.214 1.007 . . . . 0.0 109.087 177.653 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.409 ' N ' HD21 ' B' ' 31' ' ' ASN . 2.0 t -56.94 -47.12 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.1 -1.864 . . . . 0.0 110.266 -179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.706 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -48.84 -37.1 18.47 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.225 178.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.698 HD22 ' CB ' ' A' ' 33' ' ' ALA . 12.9 mt -72.46 -34.87 68.04 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.058 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -79.09 -14.63 59.02 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -130.75 19.87 5.09 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.713 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -73.03 137.02 45.11 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 178.863 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.685 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 1.4 mmpt? . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.718 178.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.29 121.53 24.54 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.3 mm? -126.43 141.65 51.81 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.3 OUTLIER -125.55 117.81 24.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.463 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.561 HG13 ' CD2' ' A' ' 7' ' ' LEU . 4.4 pt -147.33 175.56 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -92.99 98.77 11.57 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 -177.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.627 HD11 HG23 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -119.28 115.38 24.05 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.623 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.0 p -71.58 -134.94 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.442 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.4 t70 -101.21 -41.09 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -73.11 38.97 0.09 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.123 0.487 . . . . 0.0 111.914 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.78 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.7 t -160.59 -43.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.8 mt -68.97 -41.04 78.47 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 175.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.65 -39.74 91.7 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 113.425 -1.716 . . . . 0.0 108.065 176.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.78 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t0 -48.0 -36.6 13.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 114.552 -1.203 . . . . 0.0 109.352 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.74 HD11 HG12 ' A' ' 30' ' ' ILE . 43.0 mt -79.85 27.2 0.3 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.099 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -100.86 -59.08 1.76 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -79.61 -5.93 56.04 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.573 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.492 ' O ' ' N ' ' A' ' 23' ' ' GLY . 43.6 mtm -100.99 -66.05 0.93 Allowed 'General case' 0 C--N 1.341 0.228 0 CA-C-N 116.993 -0.094 . . . . 0.0 110.837 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.765 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -29.23 -32.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.388 1.075 . . . . 0.0 113.613 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.49 ' CG ' ' N ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -62.54 -139.85 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.733 177.852 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.49 ' N ' ' CG ' ' A' ' 20' ' ' ARG . 0.1 OUTLIER -41.29 -24.1 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.587 -0.695 . . . . 0.0 112.243 179.037 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 18' ' ' MET . 15.5 mm-40 -100.73 -13.0 18.67 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.765 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -142.09 17.22 2.54 Favored Glycine 0 C--O 1.223 -0.557 0 C-N-CA 116.759 -2.638 . . . . 0.0 116.973 -176.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp 52.79 -162.36 0.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 119.512 1.656 . . . . 0.0 112.996 176.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.462 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 1.7 p -61.4 161.09 9.8 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.509 -1.223 . . . . 0.0 109.714 178.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.87 -41.59 33.74 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.608 ' HA ' HD13 ' B' ' 5' ' ' ILE . 91.7 p -76.47 -51.72 11.22 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.559 ' O ' HG21 ' A' ' 32' ' ' VAL . 6.3 mt-10 -54.89 -31.22 59.72 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.715 ' HE2' HG23 ' A' ' 32' ' ' VAL . 3.5 tpt -64.47 -49.93 69.48 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 123.416 1.579 . . . . 0.0 108.877 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.74 HG12 HD11 ' A' ' 15' ' ' LEU . 0.3 OUTLIER -66.37 -19.39 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.801 0 CA-C-N 113.325 -1.761 . . . . 0.0 112.813 -177.703 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.424 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -79.27 -51.57 9.28 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.634 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.752 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -53.41 -36.17 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.972 0 CA-C-O 121.499 0.666 . . . . 0.0 109.906 178.371 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.804 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.85 -47.68 0.7 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.034 -1.439 . . . . 0.0 111.18 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.663 HD13 HD23 ' B' ' 15' ' ' LEU . 5.6 mt -83.92 -25.41 30.18 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.049 -178.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -87.92 -9.21 54.33 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.241 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.804 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -136.24 22.22 3.22 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.807 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -88.29 140.45 29.46 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.04 0.536 . . . . 0.0 110.702 179.195 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.569 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.458 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.591 0.234 . . . . 0.0 111.61 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -85.41 123.3 30.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.7 mm? -129.12 148.56 51.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.913 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -133.77 121.43 21.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.781 179.176 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.608 HD13 ' HA ' ' A' ' 27' ' ' SER . 5.0 pt -148.89 179.71 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 75.2 t-105 -97.12 101.99 13.67 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -177.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.732 ' CD1' HG21 ' A' ' 30' ' ' ILE . 0.7 OUTLIER -126.86 117.01 21.74 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 18.4 p -73.18 -149.15 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.015 0.436 . . . . 0.0 111.343 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -96.22 -150.2 0.32 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.238 -178.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . 0.417 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 0.9 OUTLIER 35.55 43.15 0.15 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.251 0.62 . . . . 0.0 112.437 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.734 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 4.1 t -172.43 -46.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 19.0 mt -74.19 -39.2 63.33 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -89.63 -36.13 15.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 113.281 -1.781 . . . . 0.0 109.871 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.734 ' HB2' ' N ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -47.67 -25.45 1.2 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.32 -179.089 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.716 ' HB2' ' HB2' ' B' ' 18' ' ' MET . 4.2 pp -83.81 34.18 0.49 Allowed 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.434 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 30.3 mm-40 -53.76 -28.21 33.33 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -97.53 -5.94 34.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.716 ' HB2' ' HB2' ' B' ' 15' ' ' LEU . 14.2 mtm -89.84 -80.43 0.31 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.838 0.29 . . . . 0.0 110.562 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.675 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -49.03 -44.42 41.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.783 0.433 . . . . 0.0 111.846 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 2.2 mmm180 -62.74 -68.81 0.3 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 111.807 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -32.6 36.72 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.981 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.507 ' HB2' ' O ' ' B' ' 18' ' ' MET . 21.4 mm-40 -84.9 -11.31 55.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.061 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.64 10.13 75.52 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.281 -177.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.675 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 92.4 mt -83.22 165.08 19.73 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.583 0.706 . . . . 0.0 111.58 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 72.6 p -107.26 164.71 11.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.141 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.13 -37.48 1.44 Allowed 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.529 ' HA ' HD11 ' A' ' 5' ' ' ILE . 3.4 t -82.42 -56.9 3.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.464 ' HB3' HD21 ' B' ' 24' ' ' LEU . 2.7 mm-40 -60.19 -14.22 16.35 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.887 0.375 . . . . 0.0 110.761 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.642 ' SD ' HD21 ' B' ' 15' ' ' LEU . 3.1 tpt -79.23 -46.39 17.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.831 1.3 . . . . 0.0 108.24 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.627 HG23 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -78.06 -31.34 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.104 0 CA-C-N 112.656 -2.066 . . . . 0.0 113.594 -177.26 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -48.38 64.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.24 1.019 . . . . 0.0 109.331 177.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 1.4 t -59.75 -43.0 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 CA-C-N 113.071 -1.877 . . . . 0.0 111.154 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.807 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -46.28 -34.43 4.46 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.114 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.689 HD22 ' HB1' ' A' ' 33' ' ' ALA . 13.5 mt -88.94 -28.48 20.24 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -74.8 -11.01 60.05 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -123.27 27.06 7.69 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.593 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 33.7 t80 -115.99 155.21 28.47 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 111.723 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.427 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.227 178.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.592 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.6 mpt_? . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.951 0.405 . . . . 0.0 111.735 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -107.71 109.23 20.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.56 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.427 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 2.2 tp -127.99 147.21 50.49 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.206 -178.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -108.84 138.21 45.54 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.544 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.57 HG13 HD22 ' A' ' 7' ' ' LEU . 2.1 pt -148.5 -179.9 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.441 ' O ' ' HB2' ' B' ' 27' ' ' SER . 73.0 t-105 -97.13 93.72 6.72 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -177.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.696 ' CD1' HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -125.78 103.67 7.93 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.896 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.555 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.1 p -74.38 -176.11 2.56 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.781 0.8 . . . . 0.0 112.439 -178.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.5 -49.03 65.58 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.689 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -46.05 -34.23 3.96 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.853 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -100.45 -22.38 15.05 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 8' ' ' SER . 59.9 mt -71.55 -39.89 70.36 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 176.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 16' ' ' GLU . 1.3 mm-40 -63.89 -40.61 96.9 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 113.427 -1.715 . . . . 0.0 107.53 175.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.853 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -51.17 -43.29 61.27 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.513 -1.221 . . . . 0.0 108.923 178.138 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.729 HD13 HG12 ' A' ' 30' ' ' ILE . 25.0 mt -86.42 26.43 1.07 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 52.2 mt-10 -106.25 -53.42 2.63 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -76.3 -39.62 53.7 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.369 178.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.543 ' HE2' ' SD ' ' A' ' 29' ' ' MET . 35.4 mtm -68.24 -71.77 0.2 Allowed 'General case' 0 C--N 1.341 0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.655 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.77 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -28.08 -32.09 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.165 1.386 . . . . 0.0 114.302 -178.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.495 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.8 mmm180 -65.66 -121.92 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.398 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.52 -22.62 8.54 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.824 -0.547 . . . . 0.0 111.654 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 1.4 mp0 -108.1 -7.68 16.02 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 -177.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.77 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -144.18 19.62 2.11 Favored Glycine 0 CA--C 1.504 -0.617 0 C-N-CA 116.015 -2.993 . . . . 0.0 117.416 -176.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.553 HD11 HG21 ' A' ' 32' ' ' VAL . 1.0 OUTLIER 52.61 -160.06 0.12 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 119.576 1.688 . . . . 0.0 113.052 175.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.46 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 12.9 p -64.02 159.54 19.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.787 178.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.55 -38.84 6.81 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.708 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 22.3 m -81.51 -51.17 8.56 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 111.325 0.121 . . . . 0.0 111.325 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.537 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 4.4 mt-10 -56.56 -27.17 57.16 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.573 ' SD ' ' HA3' ' A' ' 23' ' ' GLY . 3.8 tpt -63.26 -47.69 81.33 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 122.951 1.357 . . . . 0.0 108.996 177.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.729 HG12 HD13 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -76.95 -36.74 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.599 0 CA-C-N 112.678 -2.055 . . . . 0.0 114.29 -176.456 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.41 HD21 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -63.5 -47.06 83.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.015 0.912 . . . . 0.0 108.927 178.04 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.553 HG21 HD11 ' A' ' 24' ' ' LEU . 0.9 OUTLIER -59.65 -42.78 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.503 0 CA-C-N 113.431 -1.713 . . . . 0.0 110.795 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.662 ' HB3' ' HB3' ' B' ' 33' ' ' ALA . . . -52.59 -38.92 61.0 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.965 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.575 HD21 ' CB ' ' B' ' 33' ' ' ALA . 13.9 mt -73.98 -29.86 62.19 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.59 -178.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -18.6 54.82 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.965 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -107.0 -36.67 6.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.602 ' CE2' ' HB3' ' B' ' 18' ' ' MET . 2.7 t80 -29.06 134.05 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.259 0.623 . . . . 0.0 111.891 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.853 -1.07 . . . . 0.0 112.892 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -82.4 108.99 16.25 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.0 tp -130.26 145.38 51.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.182 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.0 OUTLIER -103.6 139.61 38.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.552 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.686 ' CD1' HG23 ' A' ' 30' ' ' ILE . 3.5 pt -148.17 179.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.708 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.8 t-105 -98.66 100.36 11.58 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -177.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.523 HD21 HG13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -133.22 114.04 13.36 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 177.378 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.592 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -94.85 -166.35 1.45 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.524 0.678 . . . . 0.0 112.347 -178.244 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -44.93 -63.61 0.88 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.729 -1.123 . . . . 0.0 112.871 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -53.15 -27.23 20.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.627 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 70.0 p -91.08 -34.52 15.05 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' B' ' 8' ' ' SER . 56.2 mt -67.61 -37.96 83.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -43.35 88.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 113.561 -1.654 . . . . 0.0 107.526 176.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.627 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -52.58 -44.02 65.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.406 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.636 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 16.5 mt -76.29 29.64 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -114.56 -57.5 2.26 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.42 -31.56 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.636 178.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.602 ' HB3' ' CE2' ' A' ' 37' ' ' TYR . 7.9 mtm -82.51 -16.15 49.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.866 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.753 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.73 -65.28 0.97 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.858 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mtp-105 -60.89 -65.91 0.62 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.127 0.489 . . . . 0.0 111.533 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.19 -29.87 6.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.863 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.727 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -85.47 -35.31 21.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.631 179.525 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.461 ' N ' ' HG3' ' B' ' 22' ' ' GLU . . . 106.56 67.81 0.67 Allowed Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.919 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.753 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -178.26 -177.34 0.57 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.272 0.558 . . . . 0.0 112.059 178.299 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' SER . . . . . 0.406 ' N ' HD22 ' B' ' 24' ' ' LEU . 19.1 p -110.81 170.75 7.89 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.121 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.449 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.8 mttm -40.88 -38.73 1.0 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -179.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.441 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 1.5 p -79.05 -56.66 4.21 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 117.838 0.29 . . . . 0.0 111.612 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.684 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.1 mt-10 -61.55 -15.63 40.35 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.636 ' HG2' ' HB3' ' B' ' 15' ' ' LEU . 2.7 tpt -77.15 -48.28 18.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 122.743 1.259 . . . . 0.0 108.279 178.141 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.696 HG22 ' CD1' ' A' ' 7' ' ' LEU . 0.4 OUTLIER -75.88 -31.75 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.164 0 CA-C-N 112.885 -1.962 . . . . 0.0 113.462 -177.358 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -68.41 -47.92 66.01 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 122.271 1.034 . . . . 0.0 108.871 177.449 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.429 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.7 t -57.98 -44.69 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.038 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.662 ' HB3' ' HB3' ' A' ' 33' ' ' ALA . . . -49.09 -30.52 6.58 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.033 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.67 HD13 HD13 ' A' ' 15' ' ' LEU . 15.5 mt -80.93 -35.66 32.07 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.996 -177.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -77.86 -11.62 59.91 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -125.19 18.81 8.32 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.651 0.262 . . . . 0.0 111.215 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.42 132.59 38.57 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.767 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.636 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.605 178.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.623 ' HB2' HD23 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -88.4 118.92 28.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.519 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.3 mm? -136.92 148.64 47.11 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.382 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -121.09 130.47 53.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 178.799 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.611 HD11 ' HA ' ' B' ' 27' ' ' SER . 1.3 pt -147.79 -179.79 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.407 ' O ' ' HB2' ' B' ' 27' ' ' SER . 69.3 t-105 -95.2 89.26 5.45 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.636 HD12 HG22 ' B' ' 30' ' ' ILE . 2.1 mm? -120.58 99.36 6.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 p -74.8 -141.04 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.208 -178.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -79.58 -155.33 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.733 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 36.82 43.85 0.31 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.279 0.632 . . . . 0.0 112.412 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.676 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 11.8 t -174.96 -48.2 0.01 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.096 -0.957 . . . . 0.0 112.152 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.46 ' H ' HG23 ' A' ' 11' ' ' THR . 15.1 mt -78.23 -39.71 39.55 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 105.68 -1.97 . . . . 0.0 105.68 175.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -41.9 62.94 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 113.268 -1.787 . . . . 0.0 106.933 176.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.676 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.02 -27.3 7.53 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.017 -1.447 . . . . 0.0 109.569 178.231 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.763 ' CD1' ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -76.64 31.34 0.13 Allowed 'General case' 0 N--CA 1.426 -1.643 0 C-N-CA 124.161 0.984 . . . . 0.0 113.044 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -74.65 -61.52 1.85 Allowed 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.288 -0.257 . . . . 0.0 111.535 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -98.11 7.2 46.65 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.652 ' HB2' HD13 ' A' ' 15' ' ' LEU . 23.2 mtm -88.18 -82.05 0.24 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.879 0.309 . . . . 0.0 111.617 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.764 ' HA ' ' CA ' ' A' ' 23' ' ' GLY . . . -23.87 -35.78 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 126.444 1.898 . . . . 0.0 114.286 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 18' ' ' MET . 5.0 mtt-85 -68.52 -117.97 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.087 179.226 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.9 -23.32 6.88 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.563 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 4.4 mt-10 -116.67 4.21 13.1 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -177.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.764 ' CA ' ' HA ' ' A' ' 19' ' ' ALA . . . -149.34 16.56 1.14 Allowed Glycine 0 CA--C 1.502 -0.729 0 C-N-CA 115.398 -3.286 . . . . 0.0 117.417 -177.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.492 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp 52.83 -158.54 0.14 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 119.792 1.796 . . . . 0.0 112.671 176.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.44 ' O ' ' N ' ' A' ' 29' ' ' MET . 1.5 m -70.53 150.3 46.26 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.149 178.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -38.79 -39.43 0.51 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.451 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 m -81.12 -54.96 5.08 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 122.028 0.131 . . . . 0.0 110.734 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -55.32 -29.88 59.15 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.763 ' SD ' ' CD1' ' A' ' 15' ' ' LEU . 4.1 tpt -59.45 -47.49 85.3 Favored 'General case' 0 N--CA 1.44 -0.975 0 CA-C-O 123.028 1.394 . . . . 0.0 109.714 177.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.535 HG22 HD13 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -75.77 -21.39 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.686 0 CA-C-N 112.257 -2.247 . . . . 0.0 113.779 -175.812 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.536 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -78.18 -51.57 10.02 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.983 0.897 . . . . 0.0 109.985 177.164 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.412 ' N ' HD21 ' A' ' 31' ' ' ASN . 1.6 t -63.53 -34.98 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-N 113.705 -1.589 . . . . 0.0 111.155 -179.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.674 ' HB1' ' CB ' ' B' ' 33' ' ' ALA . . . -46.9 -61.45 1.86 Allowed 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.339 -1.301 . . . . 0.0 112.438 -179.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.723 ' N ' ' HB2' ' B' ' 33' ' ' ALA . 0.0 OUTLIER -74.71 -28.09 60.66 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.048 -176.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.605 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 9.2 mt-30 -56.55 -24.4 46.71 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.435 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -125.48 31.53 5.53 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.411 0.624 . . . . 0.0 109.505 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.712 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -87.85 139.38 30.58 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.171 179.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.555 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.123 -0.941 . . . . 0.0 111.187 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.542 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 2.2 ttt-85 . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -73.97 128.08 34.57 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -133.29 140.47 47.47 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.517 -178.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -121.55 130.25 53.41 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.3 pp -150.9 165.0 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -85.48 103.6 14.5 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.761 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.552 ' O ' HD22 ' B' ' 12' ' ' LEU . 1.1 tp -124.69 113.87 18.57 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.456 ' O ' HD22 ' B' ' 12' ' ' LEU . 12.5 p -77.03 -173.44 2.74 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 121.449 0.642 . . . . 0.0 110.74 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.426 ' HA ' HD21 ' B' ' 12' ' ' LEU . 4.7 p-10 -59.41 -155.77 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.562 -1.199 . . . . 0.0 112.528 -178.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . 0.484 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.7 tt0 37.45 39.84 0.19 Allowed 'General case' 0 C--N 1.344 0.349 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.69 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.2 t 177.61 -51.56 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.965 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.623 HD23 ' HB2' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -70.64 -27.56 64.14 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.002 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.31 -43.41 6.96 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.415 -1.72 . . . . 0.0 107.66 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.69 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.7 m-20 -56.17 -16.4 5.18 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.201 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.82 HD12 ' SD ' ' B' ' 29' ' ' MET . 0.1 OUTLIER -70.32 23.58 0.03 OUTLIER 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.84 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' B' ' 14' ' ' ASP . 6.6 mm-40 -87.61 -36.25 17.61 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 11.1 pttm -102.97 -1.92 28.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.723 ' HE2' ' HG ' ' A' ' 34' ' ' LEU . 53.3 mtp -91.45 -84.49 0.26 Allowed 'General case' 0 C--N 1.34 0.182 0 O-C-N 122.259 -0.276 . . . . 0.0 110.45 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.613 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -45.55 -45.28 13.41 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.343 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -69.18 0.24 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 120.966 0.412 . . . . 0.0 111.769 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -33.49 42.77 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -81.3 -12.18 59.13 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.916 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.29 85.58 Favored Glycine 0 C--N 1.34 0.786 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.569 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.613 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 96.5 mt -85.04 174.89 9.38 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.736 0.779 . . . . 0.0 111.392 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 19.4 p -116.58 172.71 7.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.747 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.439 ' HB3' HG23 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -48.96 -34.2 12.49 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.611 ' HA ' HD11 ' A' ' 5' ' ' ILE . 4.6 p -86.56 -54.52 4.35 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.461 ' HB3' HD23 ' B' ' 24' ' ' LEU . 3.0 mt-10 -60.02 -11.17 5.21 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.452 0.168 . . . . 0.0 111.038 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.82 ' SD ' HD12 ' B' ' 15' ' ' LEU . 2.4 tpt -84.36 -46.98 11.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.532 1.158 . . . . 0.0 107.995 177.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.636 HG22 HD12 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -76.38 -29.76 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.139 0 CA-C-N 113.038 -1.892 . . . . 0.0 113.132 -177.359 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.495 ' HB2' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -71.49 -50.92 26.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 122.206 1.003 . . . . 0.0 109.088 177.371 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.439 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 2.0 t -54.82 -41.58 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 CA-C-N 113.164 -1.835 . . . . 0.0 110.16 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.723 ' HB2' ' N ' ' A' ' 34' ' ' LEU . . . -43.36 -43.12 4.93 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.831 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.653 HD22 ' CB ' ' A' ' 33' ' ' ALA . 9.6 mt -79.27 -29.88 42.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.922 -177.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -78.56 -16.32 57.57 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -132.55 21.04 4.29 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.463 0.574 . . . . 0.0 112.293 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.589 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -74.79 139.03 43.01 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.178 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.486 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.853 -0.594 . . . . 0.0 112.474 178.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.669 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 121.146 0.498 . . . . 0.0 112.034 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -114.12 114.36 25.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.529 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.1 tp -129.14 138.42 51.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.429 -177.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -115.97 123.82 48.99 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.612 HG13 ' CD2' ' A' ' 7' ' ' LEU . 3.9 pt -145.85 178.84 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.521 0.564 . . . . 0.0 112.521 -177.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.543 ' CZ3' ' N ' ' B' ' 1' ' ' ARG . 66.0 t-105 -90.91 98.33 11.71 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.612 ' CD2' HG13 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -130.24 107.78 9.54 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.655 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 23.0 t -72.45 -129.95 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -178.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.74 -154.8 0.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -178.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 34.95 45.96 0.18 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.28 0.632 . . . . 0.0 111.885 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.653 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 13.9 t -174.78 -48.37 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.706 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.65 ' CD1' ' HG2' ' B' ' 1' ' ' ARG . 28.4 mt -73.82 -42.5 60.82 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 176.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.07 -38.58 79.11 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 113.368 -1.742 . . . . 0.0 107.442 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.653 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 2.2 t0 -48.72 -33.8 10.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.014 -1.448 . . . . 0.0 110.198 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.637 HD21 ' SD ' ' A' ' 29' ' ' MET . 54.1 mt -69.2 16.67 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -76.23 -61.61 1.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.173 -0.329 . . . . 0.0 110.367 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -83.72 -17.57 40.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.927 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.623 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 10.8 mtm -83.01 -28.47 29.64 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.363 0.125 . . . . 0.0 111.294 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.873 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -98.04 -64.13 1.07 Allowed 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -55.45 -63.86 1.03 Allowed 'General case' 0 CA--C 1.512 -0.516 0 CA-C-O 120.83 0.347 . . . . 0.0 111.774 -178.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.62 -34.49 11.76 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.371 179.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -74.1 -28.26 61.27 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.673 179.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.93 -13.47 59.03 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.544 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.873 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -88.17 -174.27 4.59 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.778 0.323 . . . . 0.0 111.737 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 t -116.43 174.17 6.21 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.18 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.494 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -43.58 -38.63 3.07 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -179.179 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.659 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 1.5 m -76.96 -60.36 2.39 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.567 0.347 . . . . 0.0 111.458 -179.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.637 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.0 mt-10 -58.84 -17.53 24.64 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.716 ' HB2' HD21 ' A' ' 24' ' ' LEU . 2.7 tpt -75.94 -47.7 24.11 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 122.757 1.265 . . . . 0.0 108.471 177.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.494 ' HB ' ' O ' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -74.0 -35.72 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 112.7 -2.046 . . . . 0.0 113.214 -177.213 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.412 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.92 -45.85 76.65 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 122.003 0.906 . . . . 0.0 108.882 176.932 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.493 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -58.91 -41.32 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.575 0 CA-C-N 113.387 -1.733 . . . . 0.0 110.282 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.584 ' HB2' ' HB3' ' B' ' 33' ' ' ALA . . . -52.69 -38.27 60.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.99 178.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.603 HD23 ' CB ' ' B' ' 33' ' ' ALA . 17.8 mt -71.66 -30.41 65.68 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.074 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -79.79 -17.19 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.387 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.56 24.4 4.75 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.71 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -77.51 125.09 28.78 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.72 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.092 -0.956 . . . . 0.0 111.343 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.655 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -88.97 134.76 33.86 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.7 tp -129.34 142.51 50.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.606 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -125.85 127.5 46.16 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.368 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.4 pp -154.37 169.56 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.659 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 66.5 t-105 -80.88 113.92 19.41 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.409 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 15.1 tp -144.96 102.26 3.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -178.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.669 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 14.0 p -79.29 178.08 8.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -176.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.422 ' HB2' ' NH2' ' A' ' 1' ' ' ARG . 9.3 t70 -51.74 -50.63 60.23 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 113.093 -1.867 . . . . 0.0 112.497 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -47.74 -27.82 2.17 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.603 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 22.2 p -100.32 -22.78 14.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' B' ' 8' ' ' SER . 31.2 mt -79.21 -42.3 26.33 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 178.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.496 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.0 mt-10 -62.04 -41.72 98.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.033 -1.439 . . . . 0.0 107.507 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.603 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.75 -45.4 58.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.325 -1.307 . . . . 0.0 109.699 178.171 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.805 HD11 ' CG ' ' B' ' 18' ' ' MET . 1.2 mm? -82.53 22.2 0.89 Allowed 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.619 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.2 OUTLIER -80.34 -47.93 13.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.819 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.619 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 24.3 mtpp -102.92 -10.81 18.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.837 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.805 ' CG ' HD11 ' B' ' 15' ' ' LEU . 0.1 OUTLIER -105.86 4.64 29.92 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.027 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.843 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -99.76 -15.22 18.54 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.883 -0.51 . . . . 0.0 112.367 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 -77.89 -97.9 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.61 -27.63 62.92 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.922 0.391 . . . . 0.0 110.59 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' B' ' 18' ' ' MET . 24.4 mm-40 -101.95 -21.12 14.58 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.843 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -102.51 -20.59 11.73 Favored Glycine 0 N--CA 1.467 0.706 0 C-N-CA 119.907 -1.14 . . . . 0.0 113.09 -179.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.848 ' CD2' ' HB3' ' B' ' 28' ' ' GLU . 0.0 OUTLIER 44.84 27.96 0.31 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 179.146 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' SER . . . . . 0.721 ' HB2' ' HB2' ' B' ' 28' ' ' GLU . 0.5 OUTLIER 132.1 142.06 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 127.659 2.384 . . . . 0.0 109.449 177.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -45.84 -50.8 13.85 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 117.676 0.216 . . . . 0.0 111.206 -178.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.594 ' HA ' HD12 ' A' ' 5' ' ' ILE . 73.4 p -81.43 -35.71 30.31 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.594 0.235 . . . . 0.0 110.869 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.848 ' HB3' ' CD2' ' B' ' 24' ' ' LEU . 13.4 mm-40 -61.72 -26.93 68.36 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.035 179.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.804 ' HG2' ' HG ' ' B' ' 15' ' ' LEU . 0.0 OUTLIER -68.12 -38.18 81.96 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-O 122.534 1.159 . . . . 0.0 109.263 178.52 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.565 HG22 ' CD1' ' A' ' 7' ' ' LEU . 0.3 OUTLIER -80.17 -30.66 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.5 0 CA-C-N 112.999 -1.909 . . . . 0.0 112.837 -175.363 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -44.8 86.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.474 HG21 HD13 ' B' ' 24' ' ' LEU . 2.1 t -58.41 -48.34 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.375 0 CA-C-N 112.422 -2.172 . . . . 0.0 111.854 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.603 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -47.14 -40.57 15.94 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.557 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.611 HD11 HD23 ' A' ' 15' ' ' LEU . 12.3 mt -75.73 -32.11 59.89 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.157 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 11.8 mt-30 -78.47 -15.15 58.94 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 25.9 m80 -122.28 6.15 9.67 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.511 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -64.7 139.31 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.688 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 123.396 0.678 . . . . 0.0 112.368 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.545 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 1.2 ttt-85 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -73.18 123.36 23.49 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 178.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.505 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 2.2 tp -131.01 149.32 52.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.791 -178.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -118.33 132.32 56.28 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.995 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.706 ' CD1' HG21 ' B' ' 30' ' ' ILE . 3.6 pt -147.53 176.54 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.52 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 72.2 t-105 -96.57 103.59 15.51 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -177.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.52 HD22 HG13 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -131.86 113.63 13.7 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.636 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.639 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 12.6 p -79.17 -176.85 5.35 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.727 0.775 . . . . 0.0 112.707 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -47.16 -60.42 2.49 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.369 -1.287 . . . . 0.0 112.552 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -50.61 -25.88 4.7 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.54 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 23.6 p -94.21 -34.08 13.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.7 mt -65.43 -41.13 93.84 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.42 -43.95 97.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 113.846 -1.524 . . . . 0.0 108.508 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.535 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -55.23 -50.05 70.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.491 179.081 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.73 ' CD1' HG12 ' A' ' 30' ' ' ILE . 14.2 mt -75.07 17.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 10.3 mm-40 -115.31 -56.35 2.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.1 mttp -76.23 -31.64 58.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.042 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.498 ' HE3' ' HE2' ' A' ' 29' ' ' MET . 0.7 OUTLIER -97.88 21.12 11.01 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.184 0.516 . . . . 0.0 111.425 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.656 ' HA ' HD21 ' A' ' 24' ' ' LEU . . . -110.97 -64.72 1.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -54.38 -68.48 0.18 Allowed 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.162 0.506 . . . . 0.0 111.542 179.054 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -34.39 26.86 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.515 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 18' ' ' MET . 14.0 mm-40 -76.06 -27.36 57.22 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.938 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.408 ' O ' ' HB3' ' A' ' 24' ' ' LEU . . . 111.0 49.31 0.68 Allowed Glycine 0 C--N 1.34 0.758 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.29 179.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.694 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER 179.87 -175.88 0.3 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.567 0.699 . . . . 0.0 112.316 178.632 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.519 ' N ' HD22 ' A' ' 24' ' ' LEU . 3.3 t -117.65 -179.42 3.73 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.559 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -45.06 -38.2 4.78 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.566 ' HA ' HD12 ' B' ' 5' ' ' ILE . 12.0 m -78.01 -62.57 1.63 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.694 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 4.4 mt-10 -59.99 -14.49 16.35 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.782 ' HE3' HG22 ' A' ' 32' ' ' VAL . 2.1 tpt -78.44 -47.12 18.16 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 123.791 1.758 . . . . 0.0 107.115 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.73 HG12 ' CD1' ' A' ' 15' ' ' LEU . 0.5 OUTLIER -64.84 -20.81 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.69 0 CA-C-N 113.065 -1.879 . . . . 0.0 112.19 -179.131 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.47 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -79.39 -52.52 7.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.152 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.782 HG22 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -52.05 -33.21 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.848 0 CA-C-O 121.462 0.649 . . . . 0.0 110.395 178.525 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.843 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.2 -43.01 0.33 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.822 -1.535 . . . . 0.0 111.059 178.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.717 HD12 HD22 ' B' ' 15' ' ' LEU . 7.1 mt -84.63 -35.2 22.83 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.425 -179.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -69.16 -25.6 64.44 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.843 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 6.9 p-80 -101.15 -29.58 12.04 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.712 0.687 . . . . 0.0 112.474 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.671 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 9.1 t80 -50.68 144.07 8.67 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 117.917 -1.04 . . . . 0.0 112.251 178.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.639 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 121.034 0.445 . . . . 0.0 111.809 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -110.06 116.29 31.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.137 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.2 mm? -131.9 150.66 52.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.258 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -117.17 132.78 56.57 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.579 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.566 HD12 ' HA ' ' A' ' 27' ' ' SER . 1.3 pt -151.52 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 72.2 t-105 -94.89 97.02 9.7 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -177.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.662 ' HB3' HG21 ' B' ' 11' ' ' THR . 2.2 mm? -130.38 108.09 9.73 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 27.5 t -67.96 -125.78 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -176.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.427 ' C ' ' H ' ' B' ' 11' ' ' THR . 14.4 t70 -101.1 -40.12 7.35 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -176.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -72.34 39.69 0.08 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.662 HG21 ' HB3' ' B' ' 7' ' ' LEU . 6.5 t -162.19 -41.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.514 ' N ' HG22 ' B' ' 11' ' ' THR . 20.2 mt -74.37 -42.67 58.92 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.23 -37.78 72.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.567 -1.651 . . . . 0.0 108.151 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.656 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.2 t70 -45.38 -33.68 2.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.723 HD23 ' CG ' ' B' ' 29' ' ' MET . 41.5 mt -82.47 27.51 0.5 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -97.71 -51.63 4.03 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -82.84 -17.29 44.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.506 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.49 ' HA ' ' HB2' ' B' ' 22' ' ' GLU . 14.3 mtm -92.23 -70.19 0.71 Allowed 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.314 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.756 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -28.68 -31.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.916 1.286 . . . . 0.0 114.358 -178.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.46 ' N ' ' O ' ' B' ' 18' ' ' MET . 9.0 mtp-105 -67.19 -121.71 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.918 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 tpp85 -52.46 -23.96 7.08 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.915 -0.491 . . . . 0.0 111.645 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.49 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 0.8 OUTLIER -108.08 -1.65 20.25 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -177.519 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.756 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -151.01 20.43 0.97 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 115.623 -3.179 . . . . 0.0 117.912 -176.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.577 HD12 HG23 ' B' ' 32' ' ' VAL . 1.1 mp 50.26 -157.33 0.09 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 120.108 1.954 . . . . 0.0 113.254 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -64.57 162.65 15.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.681 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.44 -44.58 17.47 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.52 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 14.8 m -82.91 -47.91 11.28 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.165 0.061 . . . . 0.0 111.165 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.457 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 2.6 mt-10 -55.61 -28.31 54.51 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.738 ' SD ' ' HA3' ' B' ' 23' ' ' GLY . 3.9 tpt -63.61 -48.69 76.3 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.682 1.229 . . . . 0.0 109.537 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.715 HG12 HD11 ' B' ' 15' ' ' LEU . 0.3 OUTLIER -77.54 -30.32 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.668 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.877 -176.289 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.455 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -68.51 -48.12 65.2 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.044 177.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.577 HG23 HD12 ' B' ' 24' ' ' LEU . 1.4 t -58.37 -43.85 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-N 113.314 -1.766 . . . . 0.0 110.675 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.671 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -51.34 -32.75 26.68 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.783 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.649 HD23 ' HB3' ' A' ' 33' ' ' ALA . 11.2 mt -83.82 -28.99 27.67 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.889 -178.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -74.51 -16.24 60.84 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.278 0.474 . . . . 0.0 112.278 -179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.9 m80 -123.05 42.22 3.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.788 0.328 . . . . 0.0 111.104 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.717 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.6 OUTLIER -58.14 133.13 55.33 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.423 0.63 . . . . 0.0 112.108 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.637 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 4.2 tptt . . . . . 0 C--O 1.249 1.072 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.675 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.508 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.795 0 CA-C-O 120.688 0.28 . . . . 0.0 111.718 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -95.19 110.77 22.69 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.4 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 3.0 tp -123.39 145.54 48.69 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.513 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -117.32 134.99 54.17 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.56 HD13 HD21 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -157.15 177.68 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.435 ' O ' HD11 ' A' ' 7' ' ' LEU . 69.8 t-105 -91.34 101.04 13.73 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.674 HD12 HG23 ' B' ' 30' ' ' ILE . 0.4 OUTLIER -125.56 106.59 9.87 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.378 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.454 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.1 t -85.57 -137.0 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.921 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.82 -157.33 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.566 0.209 . . . . 0.0 111.566 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 35.05 43.96 0.12 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.34 0.656 . . . . 0.0 112.247 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.645 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.85 -51.21 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.598 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.521 ' N ' HG21 ' A' ' 11' ' ' THR . 16.5 mt -72.22 -40.58 67.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 2.7 mt-10 -74.98 -40.9 60.46 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.195 -1.82 . . . . 0.0 107.982 175.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.645 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -51.44 -27.61 10.77 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 114.625 -1.171 . . . . 0.0 109.948 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.832 HD13 ' SD ' ' A' ' 29' ' ' MET . 0.2 OUTLIER -80.8 36.19 0.38 Allowed 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 124.286 1.035 . . . . 0.0 112.927 -179.684 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 13' ' ' GLU . 13.3 mt-10 -79.79 -59.15 2.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.271 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -101.98 23.42 11.51 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.705 ' HB2' HD13 ' A' ' 15' ' ' LEU . 6.5 mtm -103.85 -86.25 0.45 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.186 -0.321 . . . . 0.0 110.922 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.726 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -45.75 -44.75 14.04 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.088 0.555 . . . . 0.0 111.507 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.17 -68.98 0.31 Allowed 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 120.993 0.425 . . . . 0.0 111.664 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.08 -32.02 33.05 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.213 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.469 ' HB2' ' O ' ' A' ' 18' ' ' MET . 22.2 mm-40 -85.48 -12.48 51.72 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.285 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.04 3.52 88.26 Favored Glycine 0 C--N 1.34 0.77 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.439 -177.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.726 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 99.2 mt -81.51 175.03 10.87 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.493 0.663 . . . . 0.0 111.025 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -120.81 167.79 12.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.334 177.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.41 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 2.4 mttm -43.19 -38.61 2.57 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.686 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.1 m -84.3 -54.76 4.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.485 ' HB3' HD23 ' A' ' 24' ' ' LEU . 3.3 mm-40 -62.09 -9.87 8.61 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.191 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.832 ' SD ' HD13 ' A' ' 15' ' ' LEU . 2.5 tpt -87.22 -46.98 9.23 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.616 1.198 . . . . 0.0 108.123 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.627 HG12 HD23 ' B' ' 34' ' ' LEU . 0.7 OUTLIER -75.56 -34.37 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.127 0 CA-C-N 112.948 -1.933 . . . . 0.0 112.773 -177.83 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.443 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -65.75 -48.08 73.07 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.327 1.06 . . . . 0.0 108.905 177.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.443 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 1.2 t -60.38 -40.81 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 CA-C-N 112.932 -1.94 . . . . 0.0 111.098 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.755 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -46.33 -43.98 16.41 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.885 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.567 HD13 ' CD2' ' B' ' 15' ' ' LEU . 10.5 mt -80.11 -29.41 38.99 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.809 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -66.78 -19.06 65.67 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.33 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -120.7 43.53 2.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.121 0.486 . . . . 0.0 109.908 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.597 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 70.3 t80 -80.74 161.39 24.59 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.777 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.698 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 5.3 mmpt? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.244 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.42 0.153 . . . . 0.0 111.283 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -86.12 121.56 28.9 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 mm? -138.44 153.55 48.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.301 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.996 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -113.27 129.85 56.41 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.223 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.595 ' CD1' HG23 ' A' ' 30' ' ' ILE . 3.9 pt -141.38 173.74 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.686 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 71.4 t-105 -99.43 97.71 8.71 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.549 ' CD2' HG13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -125.3 105.63 9.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.561 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.415 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 8.7 p -79.41 -164.36 0.63 Allowed 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 121.607 0.717 . . . . 0.0 112.207 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.414 ' O ' ' HG3' ' B' ' 13' ' ' GLU . 15.9 m-20 -64.47 -44.23 91.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.285 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -64.06 5.68 0.23 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.68 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.2 p -125.2 -42.89 1.97 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' B' ' 8' ' ' SER . 25.5 mt -68.86 -40.81 79.1 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.47 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.1 mt-10 -66.33 -40.27 89.78 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.144 176.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.68 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.09 -36.7 30.49 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.836 178.574 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.71 ' CD1' ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.35 31.19 0.34 Allowed 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.298 -179.492 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.47 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 4.5 pt-20 -79.52 -46.41 17.44 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.416 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 3.7 ptpp? -108.36 -4.8 17.1 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.602 ' HB2' HD11 ' B' ' 15' ' ' LEU . 22.1 mtp -83.89 -74.23 0.38 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.898 0.317 . . . . 0.0 111.812 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.719 ' HA ' ' CA ' ' B' ' 23' ' ' GLY . . . -26.61 -33.87 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.789 1.636 . . . . 0.0 114.015 -177.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' B' ' 18' ' ' MET . 8.7 mtp-105 -66.9 -114.13 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.193 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -58.92 -21.35 57.66 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.579 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 2.4 mt-10 -113.0 -5.86 13.77 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.719 ' CA ' ' HA ' ' B' ' 19' ' ' ALA . . . -143.92 16.55 2.17 Favored Glycine 0 CA--C 1.502 -0.72 0 C-N-CA 116.442 -2.79 . . . . 0.0 116.719 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' B' ' 19' ' ' ALA . 1.2 mp 52.74 -162.51 0.09 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 119.271 1.536 . . . . 0.0 112.926 176.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.8 m -62.48 157.69 19.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.102 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -40.42 23.49 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 117.594 0.179 . . . . 0.0 111.149 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -77.55 -50.34 12.78 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.619 0.247 . . . . 0.0 110.558 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.464 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 0.8 OUTLIER -58.19 -30.91 66.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.278 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.733 ' HE3' ' CG2' ' B' ' 32' ' ' VAL . 2.3 tpt -63.4 -46.13 87.83 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 123.854 1.787 . . . . 0.0 108.752 177.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.674 HG23 HD12 ' A' ' 7' ' ' LEU . 0.4 OUTLIER -67.65 -15.96 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.151 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.998 -177.385 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -47.43 12.16 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 176.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.738 ' HB ' ' CD2' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -57.79 -32.88 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.212 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.656 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 1.01 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.17 -43.91 1.13 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 113.899 -1.5 . . . . 0.0 110.884 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.627 HD23 HG12 ' A' ' 30' ' ' ILE . 8.8 mt -80.64 -31.05 36.62 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.437 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' B' ' 32' ' ' VAL . 4.3 mt-30 -87.14 -12.8 45.94 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 1.01 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -118.34 6.39 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 179.526 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.755 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -78.28 141.83 38.24 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.901 0.48 . . . . 0.0 110.468 179.547 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.449 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.903 -1.046 . . . . 0.0 112.039 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.524 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -72.4 124.35 24.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.499 HD23 ' CD2' ' B' ' 12' ' ' LEU . 1.4 tp -131.27 149.41 52.58 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.745 -178.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -117.95 128.47 54.83 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.645 ' CD1' HG22 ' B' ' 30' ' ' ILE . 4.6 pt -145.35 173.91 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.478 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 75.1 t-105 -98.83 108.99 21.82 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.619 ' O ' HD21 ' A' ' 12' ' ' LEU . 0.7 OUTLIER -124.94 121.38 34.3 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.709 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.432 ' O ' ' HB3' ' A' ' 12' ' ' LEU . 15.6 p -80.84 178.73 8.2 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-O 121.704 0.764 . . . . 0.0 110.885 -179.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.579 ' HA ' HD23 ' A' ' 12' ' ' LEU . 14.2 t70 -59.63 -43.26 93.9 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.932 -178.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -78.25 40.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 111.642 -179.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.703 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 10.3 t -174.75 -51.73 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.961 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.623 HD22 ' CD ' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -58.52 -30.41 67.04 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.33 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -92.88 -37.1 12.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.042 -1.436 . . . . 0.0 109.216 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.703 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.3 t70 -45.41 -35.32 3.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.517 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.667 HD13 HG12 ' A' ' 30' ' ' ILE . 45.6 mt -58.12 -11.31 2.46 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.24 -61.51 1.98 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 5.4 mmtm -63.65 -21.53 66.43 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.726 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.629 ' SD ' ' HA ' ' A' ' 15' ' ' LEU . 7.0 mtp -83.89 -76.42 0.29 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.01 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.703 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.89 -43.06 2.93 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.028 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 mtp85 -65.18 -70.3 0.24 Allowed 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 6.1 mmm180 -52.78 -31.74 40.11 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.134 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -83.91 -10.77 57.73 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.842 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.5 5.99 79.51 Favored Glycine 0 C--N 1.341 0.818 0 C-N-CA 120.431 -0.89 . . . . 0.0 111.701 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.703 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 97.8 mt -83.02 171.51 13.73 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.583 0.706 . . . . 0.0 111.248 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -114.84 166.73 11.45 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.425 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.64 -39.09 3.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' B' ' 6' ' ' TRP . 2.1 p -84.09 -52.92 5.9 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.436 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.5 mm-40 -62.48 -11.29 15.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.45 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.687 ' HE3' HG23 ' A' ' 32' ' ' VAL . 2.3 tpt -87.69 -48.28 7.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.41 1.576 . . . . 0.0 107.324 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.667 HG12 HD13 ' A' ' 15' ' ' LEU . 0.6 OUTLIER -68.08 -24.09 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.555 0 CA-C-N 113.571 -1.65 . . . . 0.0 112.143 -179.071 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.464 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -76.17 -46.4 28.7 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 177.155 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.797 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -57.43 -36.09 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.975 0 CA-C-O 121.57 0.7 . . . . 0.0 109.658 178.397 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.861 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -37.04 -47.27 0.72 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.193 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.58 ' HB3' ' HE3' ' B' ' 18' ' ' MET . 7.8 mt -83.36 -28.86 28.68 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.967 -178.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -86.64 -10.56 53.57 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.861 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -128.96 15.94 6.28 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.698 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -81.89 142.51 32.43 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.118 0.567 . . . . 0.0 109.54 178.505 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.463 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.164 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.881 178.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.623 ' CD ' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -87.83 116.73 26.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -132.34 155.82 47.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.549 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -122.23 130.66 53.39 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.569 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.523 HD13 ' CG2' ' A' ' 30' ' ' ILE . 1.4 pt -150.63 -178.27 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.404 ' O ' ' HB2' ' A' ' 27' ' ' SER . 73.7 t-105 -94.6 93.26 7.48 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -177.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.575 HD12 ' CG2' ' A' ' 30' ' ' ILE . 1.6 mm? -125.12 110.76 14.52 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 25.7 t -68.35 -126.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.423 ' C ' ' H ' ' B' ' 11' ' ' THR . 13.3 t70 -103.63 -41.04 6.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -72.35 41.42 0.09 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.847 0.459 . . . . 0.0 111.95 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.665 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 6.6 t -163.44 -43.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.555 ' N ' HG21 ' B' ' 11' ' ' THR . 22.8 mt -72.65 -41.65 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.1 mt-10 -74.23 -36.04 63.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.346 -1.752 . . . . 0.0 108.541 176.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.665 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.3 t70 -46.72 -36.45 7.19 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.496 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.726 HD12 HG12 ' B' ' 30' ' ' ILE . 47.5 mt -71.51 -2.75 17.9 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.435 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.6 OUTLIER -72.3 -36.99 69.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.922 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -91.79 -9.68 42.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.426 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.58 ' HE3' ' HB3' ' A' ' 34' ' ' LEU . 6.6 mtm -100.42 -76.46 0.55 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.105 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.647 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -41.09 -44.36 2.45 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 122.595 0.358 . . . . 0.0 111.4 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.449 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.6 mmm180 -64.03 -68.57 0.34 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.028 0.442 . . . . 0.0 111.901 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -52.6 -29.68 27.21 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.252 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -90.55 -8.56 49.93 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.43 7.61 73.56 Favored Glycine 0 C--N 1.342 0.871 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.897 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.647 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.0 mt -85.67 172.88 10.53 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.525 0.679 . . . . 0.0 111.42 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -110.25 165.06 12.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.482 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.9 -41.97 12.07 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.478 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 74.6 m -84.84 -48.19 9.6 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.717 0.266 . . . . 0.0 111.717 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -64.81 -10.29 26.9 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.596 0.236 . . . . 0.0 111.223 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.569 ' CG ' ' CD2' ' B' ' 15' ' ' LEU . 3.8 tpt -85.89 -47.51 9.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.726 HG12 HD12 ' B' ' 15' ' ' LEU . 0.5 OUTLIER -73.54 -35.15 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.065 0 CA-C-N 113.092 -1.867 . . . . 0.0 113.151 -178.527 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.401 HD21 ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -65.67 -47.2 76.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.384 1.088 . . . . 0.0 109.165 177.811 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.401 ' N ' HD21 ' B' ' 31' ' ' ASN . 1.5 t -59.49 -45.23 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.051 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.698 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -47.61 -37.2 12.09 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.764 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.678 HD23 ' HB2' ' A' ' 33' ' ' ALA . 10.9 mt -81.43 -27.86 34.51 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -81.28 -13.67 58.21 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -178.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -117.46 29.67 7.74 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 118.002 0.365 . . . . 0.0 111.865 178.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.525 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 24.0 t80 -124.16 157.55 34.45 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.792 0.329 . . . . 0.0 111.649 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.469 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.016 -0.992 . . . . 0.0 112.164 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 120.367 0.127 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -82.83 120.89 26.22 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.465 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 mm? -131.18 151.39 51.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.625 -178.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.998 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -128.59 123.86 34.42 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.501 178.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.541 HG13 HD21 ' A' ' 7' ' ' LEU . 4.0 pt -146.76 176.18 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -178.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -95.65 102.46 14.26 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -177.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.636 HD12 HG23 ' B' ' 30' ' ' ILE . 0.9 OUTLIER -129.63 112.08 13.33 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.839 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.554 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 11.2 p -79.65 -178.27 6.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.895 0.855 . . . . 0.0 112.697 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -49.6 -56.43 10.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.8 -1.546 . . . . 0.0 113.036 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -44.96 -33.81 2.16 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.849 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t -96.87 -22.23 17.02 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 8' ' ' SER . 66.2 mt -73.66 -39.9 64.11 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 175.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.72 -40.17 96.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.452 175.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.849 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t0 -50.42 -45.49 55.8 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.466 177.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.747 ' HB3' ' HG2' ' A' ' 29' ' ' MET . 19.3 mt -89.75 30.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.833 179.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.557 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -113.53 -50.36 2.85 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.839 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.557 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 53.6 mttm -88.66 -29.92 19.55 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.145 179.317 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.509 ' O ' ' HA3' ' A' ' 23' ' ' GLY . 1.1 ptt? -99.13 15.94 24.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.682 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.836 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -99.57 -18.73 17.22 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 -67.29 -127.1 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.831 0 O-C-N 121.428 -0.795 . . . . 0.0 110.107 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.498 ' HA ' ' NE ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -52.96 -22.0 5.09 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 121.747 -0.596 . . . . 0.0 110.546 178.718 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -94.25 -21.48 19.01 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.836 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -138.54 16.47 3.34 Favored Glycine 0 CA--C 1.504 -0.609 0 C-N-CA 117.36 -2.352 . . . . 0.0 116.261 -177.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.613 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER 53.93 -167.4 0.07 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.645 1.222 . . . . 0.0 114.214 175.837 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -55.81 152.86 9.14 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.002 -1.454 . . . . 0.0 110.602 179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -41.79 2.95 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 120.571 0.224 . . . . 0.0 111.208 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.592 ' HA ' HD13 ' B' ' 5' ' ' ILE . 1.1 m -76.64 -51.38 11.67 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.568 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.613 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.4 mt-10 -54.53 -35.74 63.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.693 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.747 ' HG2' ' HB3' ' A' ' 15' ' ' LEU . 3.6 tpt -59.36 -45.58 91.01 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.802 1.763 . . . . 0.0 108.845 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.744 HG12 ' CD1' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -66.36 -20.79 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.711 0 CA-C-N 112.953 -1.931 . . . . 0.0 112.713 -177.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.449 ' HB2' HD13 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -80.39 -47.76 13.93 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.348 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.723 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -58.74 -32.08 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.095 0 CA-C-O 121.681 0.753 . . . . 0.0 109.138 178.468 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 1.008 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.1 -47.15 1.51 Allowed 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 113.741 -1.572 . . . . 0.0 111.225 178.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.593 HD13 ' CD2' ' B' ' 15' ' ' LEU . 9.3 mt -81.53 -25.02 36.26 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.74 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.433 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -91.78 -8.62 46.24 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 1.008 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -125.78 16.31 8.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.732 0.413 . . . . 0.0 111.965 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.803 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -87.9 137.53 32.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.118 0.567 . . . . 0.0 111.686 -179.194 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.601 -0.714 . . . . 0.0 111.324 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -81.43 120.48 25.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -128.45 145.17 51.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.659 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.998 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -124.4 123.16 39.56 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.484 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.592 HD13 ' HA ' ' A' ' 27' ' ' SER . 2.6 pt -147.76 -179.35 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -98.98 102.51 14.26 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -176.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.563 HD11 ' CG2' ' A' ' 30' ' ' ILE . 1.8 mm? -129.44 109.56 11.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 13.2 t -78.23 -132.5 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.7 -155.52 0.39 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . 0.411 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.8 mm-40 37.73 45.71 0.67 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.579 0.751 . . . . 0.0 112.637 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.692 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 9.3 t -179.17 -47.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.936 178.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 38.4 mt -69.17 -40.3 78.21 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -68.98 -39.12 79.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.275 176.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.692 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 3.2 t70 -47.96 -33.67 8.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.539 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.652 HD22 ' SD ' ' B' ' 29' ' ' MET . 57.9 mt -64.68 -5.3 5.43 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 14.5 mt-10 -62.4 -55.87 23.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.228 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.3 pttm -79.78 1.11 27.98 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.154 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.598 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 12.0 mtm -107.43 -83.11 0.54 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 111.609 0.226 . . . . 0.0 111.609 -179.154 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.709 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -43.53 -43.61 5.6 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 16.6 mtp85 -70.2 -66.0 0.65 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.976 0.417 . . . . 0.0 111.461 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.26 -32.45 37.27 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.283 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.494 ' HB2' ' O ' ' B' ' 18' ' ' MET . 21.9 mm-40 -88.44 -10.54 48.8 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.295 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.86 7.3 80.69 Favored Glycine 0 C--N 1.339 0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.502 -178.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.709 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 96.2 mt -80.27 171.51 14.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.578 0.704 . . . . 0.0 111.408 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -112.19 165.0 12.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.404 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.6 -40.0 5.43 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.0 m -83.32 -52.23 6.74 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.418 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.2 mt-10 -63.79 -11.04 23.36 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.756 -0.202 . . . . 0.0 110.958 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.652 ' SD ' HD22 ' B' ' 15' ' ' LEU . 3.0 tpt -85.16 -47.05 10.51 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 122.742 1.258 . . . . 0.0 107.704 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.636 HG23 HD12 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -75.13 -32.59 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.04 0 CA-C-N 112.889 -1.959 . . . . 0.0 113.216 -178.008 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.466 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -70.32 -50.45 39.07 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.121 0.962 . . . . 0.0 109.449 178.181 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.466 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -55.97 -42.9 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 113.219 -1.809 . . . . 0.0 110.264 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.803 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -49.44 -30.88 8.72 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.288 -1.323 . . . . 0.0 112.232 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.596 HD12 HD22 ' A' ' 15' ' ' LEU . 10.8 mt -89.66 -32.88 16.85 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -177.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -72.12 -13.45 61.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -116.52 40.84 2.8 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.619 ' HD1' ' CE1' ' A' ' 36' ' ' HIS . 63.0 t80 -83.5 163.73 20.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.9 -178.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.563 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.282 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.812 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.063 0.459 . . . . 0.0 111.757 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -105.01 113.79 27.6 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.4 tp -122.71 142.57 50.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.944 -178.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -123.68 129.58 51.34 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.121 178.486 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.579 HG13 HD22 ' A' ' 7' ' ' LEU . 2.1 pt -148.67 179.22 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.407 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.404 ' O ' ' HB3' ' B' ' 27' ' ' SER . 71.1 t-105 -96.2 90.41 5.48 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.658 HD12 HG21 ' B' ' 30' ' ' ILE . 1.9 mm? -119.16 101.26 7.87 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.447 ' HA ' ' HB2' ' B' ' 1' ' ' ARG . 51.6 p -74.76 -135.2 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.187 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.44 -156.68 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.338 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 34.32 43.68 0.09 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.355 0.662 . . . . 0.0 112.465 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.692 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -172.19 -48.88 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.932 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 8' ' ' SER . 15.3 mt -75.85 -41.25 52.96 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -77.17 -39.99 46.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.317 176.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.692 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -51.05 -24.75 4.09 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.078 178.549 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.777 HD11 ' HB2' ' A' ' 18' ' ' MET . 0.1 OUTLIER -77.45 41.96 0.33 Allowed 'General case' 0 N--CA 1.424 -1.767 0 C-N-CA 124.24 1.016 . . . . 0.0 112.637 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.649 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -91.15 -47.91 7.26 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.342 179.926 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.649 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 5.3 mtpm? -102.88 24.8 10.14 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.777 ' HB2' HD11 ' A' ' 15' ' ' LEU . 16.6 mtp -116.51 -86.05 0.62 Allowed 'General case' 0 C--O 1.223 -0.34 0 O-C-N 122.172 -0.33 . . . . 0.0 111.201 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.683 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -42.0 -45.43 3.85 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.133 0.573 . . . . 0.0 111.188 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.409 ' HD2' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -65.79 -67.18 0.46 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.147 0.498 . . . . 0.0 111.476 179.78 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.59 -32.76 29.86 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.154 179.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -86.18 -12.94 48.47 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.299 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.1 4.64 88.93 Favored Glycine 0 C--N 1.339 0.723 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.628 -178.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.683 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 98.4 mt -82.01 171.74 14.05 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.579 0.704 . . . . 0.0 111.36 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -116.96 168.6 10.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.371 177.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.457 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -45.41 -37.89 5.5 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.066 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.405 ' HA ' ' HB ' ' B' ' 5' ' ' ILE . 58.8 m -80.39 -57.39 3.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.442 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.549 ' O ' HG23 ' A' ' 32' ' ' VAL . 1.8 mm-40 -60.75 -16.21 37.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.137 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.778 ' HE1' HG22 ' A' ' 32' ' ' VAL . 2.4 tpt -82.15 -45.61 14.92 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-O 123.704 1.716 . . . . 0.0 107.853 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.556 HG22 HD13 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -66.2 -19.48 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.99 0 CA-C-N 113.355 -1.748 . . . . 0.0 111.615 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.439 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -78.1 -53.29 7.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.778 HG22 ' HE1' ' A' ' 29' ' ' MET . 0.0 OUTLIER -51.69 -32.51 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.711 0 CA-C-O 121.584 0.707 . . . . 0.0 109.548 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.911 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -40.05 -43.39 1.57 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.93 -1.486 . . . . 0.0 111.064 177.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.721 HD13 ' HB ' ' B' ' 11' ' ' THR . 6.8 mt -80.67 -29.08 36.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.824 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' A' ' 32' ' ' VAL . 8.8 mt-30 -79.08 -30.69 44.03 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.911 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 10.0 p-80 -92.05 -35.67 13.8 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 119.049 0.841 . . . . 0.0 111.895 178.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.704 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 8.1 t80 -46.53 140.44 4.34 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.607 0.242 . . . . 0.0 111.179 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.47 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 117.972 -1.013 . . . . 0.0 112.108 178.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.447 ' HB2' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.384 0.135 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -82.32 119.45 24.14 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -126.37 134.25 51.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.525 -178.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.999 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -112.25 131.01 55.73 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.032 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.647 HD13 HD13 ' B' ' 7' ' ' LEU . 2.5 pp -153.73 169.98 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 73.7 t-105 -89.04 100.44 13.22 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -178.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.647 HD13 HD13 ' B' ' 5' ' ' ILE . 1.9 mp -135.17 114.66 12.56 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.812 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -91.93 -169.86 2.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.095 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -43.41 -60.09 1.86 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.126 -1.397 . . . . 0.0 112.869 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.58 -24.72 0.94 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.721 ' HB ' HD13 ' A' ' 34' ' ' LEU . 20.4 p -103.34 -27.41 12.47 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' B' ' 8' ' ' SER . 35.7 mt -74.22 -40.57 62.36 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -62.73 -41.04 98.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.34 176.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.566 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -48.91 -40.41 29.88 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.522 179.132 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.691 HD21 HD12 ' A' ' 34' ' ' LEU . 26.3 mt -78.83 32.34 0.2 Allowed 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.494 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 44.9 mt-10 -103.1 -55.09 2.48 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.428 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 50.2 mttp -81.49 -25.15 36.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.433 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.808 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 9.5 mtm -86.2 -21.91 27.23 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.3 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.7 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.95 -68.4 0.83 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.828 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -57.8 -66.38 0.48 Allowed 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.011 0.434 . . . . 0.0 112.067 -179.599 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . 0.428 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -49.53 -34.18 16.72 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.368 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.518 ' HB2' ' O ' ' B' ' 18' ' ' MET . 20.2 mm-40 -85.08 -10.7 56.59 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.243 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.03 -7.47 81.26 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.752 -178.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.7 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 73.8 mt -74.53 173.83 9.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.606 0.717 . . . . 0.0 111.596 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.3 p -119.05 166.01 13.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.582 178.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.67 -39.67 3.73 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.55 ' HA ' HD12 ' A' ' 5' ' ' ILE . 1.4 m -84.14 -54.07 5.08 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 121.961 0.104 . . . . 0.0 111.19 -179.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.03 -8.79 5.8 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.648 0.261 . . . . 0.0 111.113 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.808 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.5 tpt -85.91 -47.96 9.16 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.658 HG21 HD12 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -75.63 -30.92 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.995 0 CA-C-N 113.003 -1.908 . . . . 0.0 113.283 -177.726 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.448 ' HB2' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -69.97 -49.83 47.84 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.263 1.03 . . . . 0.0 109.297 177.629 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.428 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -58.34 -43.13 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.082 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.727 ' HB1' ' HB2' ' A' ' 33' ' ' ALA . . . -46.23 -41.9 13.52 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.563 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.672 HD21 ' HB2' ' A' ' 33' ' ' ALA . 8.5 mt -80.25 -28.62 38.42 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.157 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -70.62 -17.65 62.88 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -119.39 42.98 2.73 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.046 0.45 . . . . 0.0 110.903 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.638 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 69.6 t80 -55.95 172.63 0.18 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.645 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.429 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.155 0 C-N-CA 123.569 0.748 . . . . 0.0 111.961 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.608 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 120.93 0.395 . . . . 0.0 111.825 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 76.1 m95 -114.91 107.29 15.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.582 177.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -122.15 140.67 52.27 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.294 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.983 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -106.94 135.36 48.63 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.486 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.547 HG13 HD23 ' A' ' 7' ' ' LEU . 1.1 pt -151.65 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -95.12 89.37 5.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.564 HD13 HG22 ' B' ' 30' ' ' ILE . 1.6 mm? -129.24 100.94 5.78 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.491 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 12.7 p -69.67 -171.55 0.4 Allowed 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 122.028 0.918 . . . . 0.0 112.651 -177.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.31 -39.16 82.16 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.209 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.623 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 31.2 mt-30 -75.63 42.19 0.22 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.679 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.652 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 1.3 t -169.3 -31.87 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.483 ' CD2' HD21 ' B' ' 3' ' ' LEU . 16.7 mt -82.77 -43.08 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 177.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.9 -29.19 18.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.554 -1.657 . . . . 0.0 110.015 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.652 ' HB2' ' N ' ' A' ' 11' ' ' THR . 14.4 t70 -46.46 -13.58 0.02 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.709 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.857 ' HB2' ' HG3' ' A' ' 18' ' ' MET . 0.0 OUTLIER -140.14 46.45 1.84 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 179.224 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 6.3 mt-10 -49.67 -28.61 6.13 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 178.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.504 ' HA ' ' HB2' ' A' ' 21' ' ' ARG . 4.1 mtmp? -71.8 -48.12 48.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.857 ' HG3' ' HB2' ' A' ' 15' ' ' LEU . 16.0 mtm -59.08 -28.75 66.77 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.698 0.285 . . . . 0.0 111.331 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.728 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -98.79 -60.32 1.56 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.0 mtp85 -70.56 -68.07 0.45 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.504 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 13.2 mmp_? -50.23 -31.61 14.43 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.852 -179.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.581 ' HB2' ' O ' ' A' ' 18' ' ' MET . 19.6 mm-40 -85.5 -15.38 43.02 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.954 179.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.11 -1.95 85.08 Favored Glycine 0 C--N 1.339 0.749 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.783 -178.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.728 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 82.9 mt -73.97 178.4 4.98 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.686 0.755 . . . . 0.0 111.512 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.463 ' O ' ' HB3' ' A' ' 29' ' ' MET . 52.2 p -117.43 165.47 13.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.025 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 mttm -47.7 -37.88 13.99 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.548 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.2 m -85.55 -50.81 6.94 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.16 -11.32 8.56 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.939 0.149 . . . . 0.0 111.055 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.741 ' C ' ' SD ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -84.27 -42.31 15.99 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.029 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.601 ' HA ' HD23 ' B' ' 34' ' ' LEU . 0.3 OUTLIER -77.28 -39.63 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.254 0 CA-C-N 112.901 -1.954 . . . . 0.0 113.269 -176.974 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.432 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -58.01 -46.2 85.65 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.325 1.059 . . . . 0.0 108.337 176.914 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.432 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -58.81 -43.48 88.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.062 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.689 ' CB ' HD21 ' B' ' 34' ' ' LEU . . . -60.46 -38.13 83.21 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.796 178.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.707 HD23 ' CB ' ' B' ' 33' ' ' ALA . 16.7 mt -70.3 -26.68 63.9 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.181 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.501 ' HG2' ' CE1' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -78.74 -30.19 45.67 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.129 -178.441 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.501 ' CE1' ' HG2' ' A' ' 35' ' ' GLN . 1.9 m80 -120.1 32.74 5.9 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.543 0.61 . . . . 0.0 111.375 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.561 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -83.26 132.21 35.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 122.476 -0.14 . . . . 0.0 110.657 179.326 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.548 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.483 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.491 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -78.81 116.63 19.27 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.483 HD21 ' CD2' ' A' ' 12' ' ' LEU . 1.7 tp -138.44 148.96 44.99 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.241 -178.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.983 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -107.04 134.93 49.44 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.399 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.574 ' CD1' HG21 ' A' ' 30' ' ' ILE . 4.3 pt -136.83 170.46 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.548 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 73.2 t-105 -97.11 102.33 14.08 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.562 ' CD2' HG13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -131.81 113.16 13.16 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.662 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.608 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 15.7 p -76.18 -173.9 2.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 112.025 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -48.52 -62.12 1.66 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.352 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -50.85 -28.89 10.43 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.574 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 69.3 p -88.01 -32.63 18.72 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' B' ' 8' ' ' SER . 67.9 mt -68.64 -40.45 80.29 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 177.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.85 -42.72 98.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 113.538 -1.664 . . . . 0.0 107.771 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.642 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -55.51 -46.74 76.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.092 178.589 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.614 HD21 HD11 ' A' ' 34' ' ' LEU . 15.0 mt -73.24 25.89 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 43.5 mt-10 -111.49 -56.59 2.36 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.68 -29.57 61.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.814 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 21.4 mtm -82.99 -22.35 33.69 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.772 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.701 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.73 -69.06 0.78 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.558 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.459 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.4 mtp85 -55.53 -64.24 0.91 Allowed 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.33 -32.44 17.18 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.192 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.537 ' HB2' ' O ' ' B' ' 18' ' ' MET . 3.8 mm-40 -89.68 -4.92 57.52 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.403 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.26 -11.02 61.83 Favored Glycine 0 C--N 1.34 0.768 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.953 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.701 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 74.8 mt -72.07 172.75 9.53 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.743 0.782 . . . . 0.0 111.685 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 89.8 p -119.87 164.28 16.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.253 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -43.55 -36.05 1.93 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.446 ' HA ' HD11 ' A' ' 5' ' ' ILE . 1.4 m -83.51 -56.48 3.72 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 122.221 0.208 . . . . 0.0 111.363 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.471 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.3 mt-10 -62.48 -8.56 6.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.495 178.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.814 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.3 tpt -86.0 -48.59 8.53 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.564 HG22 HD13 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -73.08 -35.12 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.044 0 CA-C-N 112.966 -1.925 . . . . 0.0 112.976 -178.051 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.456 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -66.55 -49.41 66.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 122.021 0.915 . . . . 0.0 109.155 177.503 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -57.3 -42.33 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 113.393 -1.73 . . . . 0.0 111.932 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.707 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -48.86 -39.68 26.65 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.429 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.689 HD21 ' CB ' ' A' ' 33' ' ' ALA . 9.2 mt -76.65 -35.83 57.73 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.196 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -11.12 60.46 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.432 ' HD1' HG11 ' B' ' 32' ' ' VAL . 43.2 m80 -106.87 -50.53 3.09 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.947 177.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.615 ' CD2' ' SD ' ' A' ' 18' ' ' MET . 12.0 t80 -44.12 144.58 0.92 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.264 0.352 . . . . 0.0 110.9 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.472 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.012 -0.995 . . . . 0.0 112.14 178.172 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 120.933 0.397 . . . . 0.0 111.881 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -89.02 122.83 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.044 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 3.2 mm? -130.08 153.8 48.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.896 -178.586 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.985 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -127.76 129.72 47.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.409 178.898 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.573 HG13 HD22 ' A' ' 7' ' ' LEU . 1.3 pt -148.11 -179.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.694 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.406 ' O ' ' HB3' ' B' ' 27' ' ' SER . 71.7 t-105 -95.06 91.32 6.29 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -177.264 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.573 HD22 HG13 ' A' ' 5' ' ' ILE . 1.8 mm? -127.46 104.05 7.69 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.451 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.656 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 8.4 t -75.5 -137.4 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 120.557 0.218 . . . . 0.0 110.916 -178.789 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -84.27 -155.76 0.2 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.963 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 36.01 43.11 0.19 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.505 0.722 . . . . 0.0 112.675 178.885 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.719 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -173.03 -45.38 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.725 178.681 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.491 HD22 HD23 ' B' ' 3' ' ' LEU . 18.1 mt -78.37 -40.74 35.42 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 175.981 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -38.84 26.91 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 113.187 -1.824 . . . . 0.0 108.315 177.606 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.719 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -48.97 -26.47 2.54 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.009 -1.451 . . . . 0.0 110.898 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.853 ' HG ' ' SD ' ' A' ' 29' ' ' MET . 0.4 OUTLIER -82.13 24.29 0.66 Allowed 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.475 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -66.14 -40.3 90.52 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 122.249 -0.282 . . . . 0.0 110.259 178.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -105.78 -13.68 15.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.789 ' HE1' ' HB3' ' B' ' 34' ' ' LEU . 0.1 OUTLIER -106.49 5.17 29.03 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 -179.015 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.852 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -98.76 -20.95 16.62 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 178.139 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.4 mtp-105 -70.42 -124.04 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 O-C-N 121.62 -0.675 . . . . 0.0 110.112 -179.332 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.2 -25.24 3.43 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.959 0.409 . . . . 0.0 110.843 179.09 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -95.64 -19.98 19.31 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -178.731 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.852 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -135.55 12.84 4.28 Favored Glycine 0 CA--C 1.504 -0.608 0 C-N-CA 117.145 -2.455 . . . . 0.0 116.489 -177.143 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.566 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 0.6 OUTLIER 53.04 -162.91 0.1 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 118.916 1.358 . . . . 0.0 113.483 175.798 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -58.66 158.04 8.45 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.833 177.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.14 -40.76 5.21 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.231 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.9 m -77.77 -49.67 13.91 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.482 0.182 . . . . 0.0 111.277 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.566 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 9.5 mt-10 -55.96 -33.58 64.91 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.353 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.853 ' SD ' ' HG ' ' A' ' 15' ' ' LEU . 5.4 tpt -59.95 -51.91 67.67 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 123.18 1.466 . . . . 0.0 108.848 177.686 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.614 HG21 HD11 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -69.39 -29.81 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.587 0 CA-C-N 112.938 -1.937 . . . . 0.0 113.974 -177.265 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.416 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -70.44 -49.46 48.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.198 0.999 . . . . 0.0 108.882 176.706 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.527 HG23 HD13 ' A' ' 24' ' ' LEU . 1.4 t -56.33 -42.26 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.307 0 CA-C-N 113.093 -1.867 . . . . 0.0 111.434 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.72 ' CB ' HD22 ' B' ' 34' ' ' LEU . . . -48.44 -43.33 34.29 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.106 179.169 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.606 HD21 ' CB ' ' B' ' 33' ' ' ALA . 11.7 mt -70.73 -29.7 66.02 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.943 -178.141 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -76.92 -23.27 52.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.457 ' HD1' HG12 ' A' ' 32' ' ' VAL . 37.0 m80 -118.87 7.83 11.61 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 178.816 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.678 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.4 OUTLIER -61.96 138.05 58.32 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.168 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.445 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 117.883 -1.056 . . . . 0.0 112.334 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.656 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 2.1 ttt85 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -72.45 125.07 26.5 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.491 HD23 HD22 ' A' ' 12' ' ' LEU . 2.4 tp -126.37 141.24 51.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.732 -178.479 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.985 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -119.82 131.8 55.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.343 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.641 HD13 HD21 ' B' ' 7' ' ' LEU . 1.2 pp -157.19 173.05 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 121.05 0.452 . . . . 0.0 112.142 -178.434 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.8 t-105 -88.61 109.52 20.16 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.641 HD21 HD13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -130.91 122.02 26.22 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.085 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 33.7 t -78.03 -126.57 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -178.68 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.514 ' O ' ' HB3' ' B' ' 13' ' ' GLU . 12.4 t70 -105.06 -44.05 4.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.195 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.42 39.82 0.1 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.118 0.485 . . . . 0.0 111.618 -179.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.652 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 5.1 t -159.5 -41.34 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 179.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.516 ' CD2' ' HB2' ' B' ' 7' ' ' LEU . 50.3 mt -72.96 -41.86 63.99 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 176.729 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' B' ' 9' ' ' ASP . 0.1 OUTLIER -73.37 -38.29 65.74 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.196 -1.82 . . . . 0.0 107.365 176.793 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.652 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.2 t70 -47.74 -36.89 12.18 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.743 -1.571 . . . . 0.0 110.45 179.066 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.699 HD21 ' SD ' ' B' ' 29' ' ' MET . 45.7 mt -68.71 -10.92 59.23 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -179.592 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.35 -59.62 4.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.662 0.268 . . . . 0.0 110.927 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.57 -19.04 64.45 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.91 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.644 ' SD ' ' HD2' ' A' ' 37' ' ' TYR . 39.1 mtm -89.98 -77.01 0.41 Allowed 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.247 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.502 ' HA ' ' OE2' ' B' ' 22' ' ' GLU . . . -37.09 -41.52 0.37 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.138 0.575 . . . . 0.0 112.324 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -68.91 -71.02 0.24 Allowed 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.847 0.356 . . . . 0.0 111.497 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -29.81 45.79 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.08 179.326 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.613 ' HG3' ' HG ' ' B' ' 24' ' ' LEU . 3.9 pt-20 -83.71 -15.72 47.62 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.482 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.52 12.02 84.69 Favored Glycine 0 C--N 1.344 1.008 0 C-N-CA 121.214 -0.517 . . . . 0.0 114.011 178.416 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.613 ' HG ' ' HG3' ' B' ' 22' ' ' GLU . 65.1 mt -102.35 175.18 5.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.553 0.692 . . . . 0.0 111.668 -179.481 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 68.5 p -106.3 164.56 11.92 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.904 -1.043 . . . . 0.0 109.749 178.502 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.05 -39.04 1.12 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.352 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.522 ' HA ' HD11 ' A' ' 5' ' ' ILE . 1.2 m -81.15 -59.44 2.65 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 122.028 0.131 . . . . 0.0 111.3 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.476 ' HB3' HD23 ' B' ' 24' ' ' LEU . 2.3 mm-40 -57.76 -14.87 6.5 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.726 0.298 . . . . 0.0 110.922 179.036 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.699 ' SD ' HD21 ' B' ' 15' ' ' LEU . 1.7 tpt -78.41 -46.28 20.26 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 122.73 1.252 . . . . 0.0 107.996 177.743 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.628 HG12 HD13 ' B' ' 15' ' ' LEU . 0.4 OUTLIER -75.45 -29.7 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.109 0 CA-C-N 112.918 -1.946 . . . . 0.0 113.66 -177.605 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.458 ' HB2' HD13 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -70.26 -49.99 44.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.325 1.059 . . . . 0.0 109.009 177.329 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.476 HG23 HD13 ' B' ' 24' ' ' LEU . 1.9 t -56.71 -43.73 79.92 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 CA-C-N 112.958 -1.928 . . . . 0.0 110.967 -179.378 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.681 ' HB1' ' HB3' ' A' ' 33' ' ' ALA . . . -45.54 -39.34 7.34 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.341 179.072 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.789 ' HB3' ' HE1' ' A' ' 18' ' ' MET . 8.8 mt -75.97 -32.25 59.4 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.167 -177.938 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -79.92 -11.41 59.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -125.49 36.96 4.46 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.255 0.55 . . . . 0.0 111.05 177.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.7 ' HD1' ' N ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -58.37 130.08 45.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.362 178.86 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.703 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 7.1 mmpt? . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.58 176.051 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.733 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.803 0.335 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.438 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.2 m95 -79.01 166.99 21.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.473 HD23 HD23 ' B' ' 12' ' ' LEU . 2.2 tp -176.76 145.49 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.099 -179.49 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -102.27 140.42 36.58 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.616 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.653 ' CD1' HG23 ' B' ' 30' ' ' ILE . 4.4 pt -148.47 175.46 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.268 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.663 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 75.4 t-105 -101.15 105.75 16.93 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.88 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.515 HD13 ' CG2' ' B' ' 30' ' ' ILE . 0.6 OUTLIER -127.2 120.28 28.4 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.728 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 t -82.36 -129.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -178.806 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.418 ' C ' ' H ' ' A' ' 11' ' ' THR . 17.8 t70 -102.77 -40.96 6.35 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.536 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.89 41.69 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.232 0.539 . . . . 0.0 111.522 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.799 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.0 t -164.41 -44.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.347 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.9 -40.37 96.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.407 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -64.32 -42.13 96.46 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.429 -1.714 . . . . 0.0 108.132 176.403 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.799 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.3 OUTLIER -51.38 -41.33 60.61 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.356 178.244 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.694 ' HB3' ' HG2' ' A' ' 29' ' ' MET . 24.6 mt -83.96 32.72 0.48 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.98 179.789 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -107.57 -69.35 0.85 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? -76.99 -25.69 53.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.405 179.079 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.557 ' HE3' ' HB3' ' B' ' 34' ' ' LEU . 0.9 OUTLIER -94.52 8.02 43.6 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.54 179.796 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.836 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -100.29 -17.97 17.04 Favored 'General case' 0 C--O 1.214 -0.785 0 C-N-CA 122.954 0.502 . . . . 0.0 112.199 178.894 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -131.13 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.814 0 O-C-N 121.592 -0.693 . . . . 0.0 109.866 -179.899 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -23.54 1.85 Allowed 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 121.8 -0.563 . . . . 0.0 110.464 178.629 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -92.17 -23.79 19.28 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -178.563 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.836 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -137.07 17.2 3.62 Favored Glycine 0 CA--C 1.504 -0.638 0 C-N-CA 117.218 -2.42 . . . . 0.0 116.529 -177.336 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.548 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER 54.62 -166.45 0.09 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 118.799 1.3 . . . . 0.0 114.147 175.654 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.06 154.11 13.37 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.516 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -42.69 8.84 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-O 120.438 0.161 . . . . 0.0 111.209 -179.685 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.622 ' HB3' ' CB ' ' B' ' 6' ' ' TRP . 5.9 m -75.65 -44.63 41.58 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.919 179.26 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.548 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.9 OUTLIER -62.4 -37.32 85.31 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.509 179.513 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.721 ' HE2' ' CG2' ' A' ' 32' ' ' VAL . 3.3 tpt -57.99 -43.52 86.62 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 124.125 1.917 . . . . 0.0 108.36 177.058 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.692 HG12 ' CD1' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -68.61 -16.3 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.911 0 CA-C-N 112.583 -2.099 . . . . 0.0 112.949 -177.778 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -86.83 -45.13 11.17 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.901 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.721 ' CG2' ' HE2' ' A' ' 29' ' ' MET . 0.0 OUTLIER -59.0 -31.4 45.54 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.635 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.983 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -38.08 -46.84 1.06 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.319 177.951 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.64 HD11 ' HB ' ' B' ' 11' ' ' THR . 8.1 mt -82.68 -26.56 31.98 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.653 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -87.84 -13.75 41.29 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -179.789 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.983 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -117.9 4.09 12.18 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 179.699 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.681 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.8 t80 -76.56 146.38 38.39 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.8 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.471 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.202 179.442 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.433 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -90.7 105.1 17.59 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.732 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.438 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 1.9 tp -125.26 145.64 49.9 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.251 -177.77 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -103.27 136.91 42.17 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 177.627 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.661 HD13 HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -149.53 -175.0 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.015 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.622 ' CB ' ' HB3' ' A' ' 27' ' ' SER . 64.8 t-105 -92.62 91.0 7.35 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.396 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.566 ' CD1' ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -125.2 95.08 4.36 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.601 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.733 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 51.2 p -64.73 177.82 0.88 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 121.761 0.791 . . . . 0.0 111.853 -178.377 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -54.19 -52.65 60.55 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.649 -179.744 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -55.68 -26.88 47.11 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -179.169 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.64 ' HB ' HD11 ' A' ' 34' ' ' LEU . 37.1 p -82.97 -30.29 28.38 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.286 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.473 HD23 HD23 ' A' ' 3' ' ' LEU . 30.0 mt -73.77 -39.33 64.26 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 178.619 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.8 mt-10 -60.15 -41.29 92.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 113.719 -1.582 . . . . 0.0 107.612 175.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.502 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -53.21 -39.91 64.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.192 -1.367 . . . . 0.0 110.537 178.603 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.66 HD23 ' SD ' ' B' ' 29' ' ' MET . 30.9 mt -77.75 28.4 0.17 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.503 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -101.01 -49.58 4.07 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.657 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.503 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 57.0 mttm -84.61 -20.81 30.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.58 179.25 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.854 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.6 mtm -91.93 -21.04 20.79 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.612 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.687 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -102.66 -62.25 1.3 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.253 179.714 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 4.8 mtp-105 -62.21 -64.94 0.77 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.962 0.41 . . . . 0.0 111.691 -179.487 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -33.4 21.83 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.286 179.78 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.516 ' HB2' ' O ' ' B' ' 18' ' ' MET . 22.3 mm-40 -85.77 -11.57 53.19 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.292 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.1 -6.02 84.08 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.791 -178.428 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.687 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.1 mt -74.08 174.69 8.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.57 0.7 . . . . 0.0 111.529 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 23.1 p -116.95 168.88 9.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.665 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -47.52 -41.17 20.45 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.322 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.663 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 80.8 p -84.62 -49.74 8.29 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.889 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.481 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.8 mm-40 -64.35 -7.95 11.41 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.628 0.251 . . . . 0.0 110.77 178.805 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.854 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.7 tpt -85.88 -48.03 9.12 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 122.741 1.258 . . . . 0.0 107.804 177.504 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.653 HG23 ' CD1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -75.89 -38.0 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.041 0 CA-C-N 112.907 -1.951 . . . . 0.0 113.189 -177.744 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.403 HD21 ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -63.69 -46.91 83.38 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.324 1.059 . . . . 0.0 109.092 177.967 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.481 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -61.62 -43.41 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.627 -179.104 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.681 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -47.89 -30.5 4.19 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.932 179.797 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.648 HD21 ' HB2' ' A' ' 33' ' ' ALA . 12.1 mt -90.44 -30.48 17.32 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -177.145 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -71.65 -17.33 62.26 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -110.99 39.06 2.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.559 ' HD2' ' CE1' ' A' ' 36' ' ' HIS . 51.0 t80 -86.08 160.02 19.4 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.792 -178.61 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.2 mppt? . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.576 178.351 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.482 ' CB ' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.934 0.397 . . . . 0.0 111.807 . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -87.23 165.07 15.96 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.697 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.617 HD22 HD21 ' B' ' 12' ' ' LEU . 2.6 tp -167.94 147.12 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.631 -179.411 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -125.26 135.77 52.87 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.969 178.97 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.621 HD12 ' CG2' ' B' ' 30' ' ' ILE . 0.3 OUTLIER -151.22 -174.84 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -178.724 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.718 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 67.5 t-105 -97.03 95.57 7.89 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.817 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.474 ' O ' ' HB2' ' B' ' 1' ' ' ARG . 1.2 mm? -126.78 103.72 7.68 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.55 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.753 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.2 OUTLIER -95.84 -171.38 2.33 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.636 0.732 . . . . 0.0 112.661 -177.442 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -43.3 -56.44 3.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.227 -1.351 . . . . 0.0 112.367 -178.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -50.03 -28.51 7.14 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.159 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.652 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 19.8 p -97.39 -28.49 13.99 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.406 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 8' ' ' SER . 21.4 mt -75.49 -40.94 56.62 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 178.835 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.523 ' O ' ' HB3' ' A' ' 16' ' ' GLU . 2.9 mt-10 -65.79 -40.31 91.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 113.766 -1.561 . . . . 0.0 108.076 176.103 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.652 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -47.55 -45.29 26.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.59 179.039 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.824 ' HG ' ' HG2' ' A' ' 29' ' ' MET . 3.5 mm? -77.43 16.73 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -178.542 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.546 ' CG ' ' HG2' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -74.12 -46.9 39.73 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.632 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.546 ' HG2' ' CG ' ' A' ' 16' ' ' GLU . 1.5 mmtm -96.88 1.95 51.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.612 179.029 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.5 ' HB2' HD11 ' A' ' 15' ' ' LEU . 5.0 mtm -108.06 -74.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.983 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.795 ' HA ' HD22 ' A' ' 24' ' ' LEU . . . -53.46 -50.7 64.74 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.572 0.349 . . . . 0.0 111.827 -178.911 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.07 -61.05 2.89 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.14 0.495 . . . . 0.0 110.481 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.02 -34.18 28.37 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.882 -1.053 . . . . 0.0 110.046 178.65 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -73.53 -20.17 60.72 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.485 179.099 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.05 5.04 74.49 Favored Glycine 0 C--N 1.34 0.788 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.212 -179.14 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.795 HD22 ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -91.55 175.15 7.01 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.184 0.516 . . . . 0.0 111.959 -179.134 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.8 p -96.82 164.32 12.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.446 178.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -46.2 -32.14 2.84 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.763 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.618 ' HA ' HD11 ' B' ' 5' ' ' ILE . 6.7 p -77.2 -50.55 12.7 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.853 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.489 ' HB2' ' HG ' ' A' ' 24' ' ' LEU . 10.8 mt-10 -55.74 -24.43 35.14 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.851 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.824 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -78.12 -42.33 32.28 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 121.925 0.869 . . . . 0.0 109.029 178.658 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.726 HG21 HD12 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -78.25 -23.15 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.477 0 CA-C-N 114.195 -1.366 . . . . 0.0 113.359 -176.699 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -72.87 -53.34 11.67 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.749 0.785 . . . . 0.0 109.13 176.288 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.524 HG22 ' HD1' ' A' ' 36' ' ' HIS . 12.7 p -61.99 -30.89 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.962 0 CA-C-N 114.128 -1.396 . . . . 0.0 112.594 -177.673 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.728 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -42.37 -37.69 1.63 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.451 177.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.641 HD23 ' CB ' ' B' ' 33' ' ' ALA . 8.4 mt -87.89 -29.37 20.92 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.837 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -69.72 -59.46 2.93 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -177.523 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.772 ' NE2' ' HB2' ' B' ' 37' ' ' TYR . 9.7 p-80 -56.93 -36.16 69.91 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 119.158 0.89 . . . . 0.0 111.973 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.739 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 10.4 t80 -42.17 145.73 0.35 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 -177.499 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.249 1.039 0 C-N-CA 124.279 1.031 . . . . 0.0 112.769 178.299 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.753 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 120.992 0.425 . . . . 0.0 111.829 . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -108.93 116.19 31.52 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 177.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.491 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.12 144.66 51.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.388 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.993 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.02 133.35 56.11 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.502 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.618 HD11 ' HA ' ' A' ' 27' ' ' SER . 0.9 OUTLIER -149.59 -177.71 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.468 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -91.17 87.64 6.61 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -177.094 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.726 HD12 HG21 ' A' ' 30' ' ' ILE . 1.9 mm? -119.81 101.43 7.88 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.814 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.482 ' HA ' ' CB ' ' A' ' 1' ' ' ARG . 48.0 t -67.05 -117.69 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.67 -178.188 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.24 -147.35 0.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.266 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . 0.443 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.5 tm0? 34.36 44.4 0.1 Allowed 'General case' 0 C--N 1.346 0.43 0 C-N-CA 123.847 0.859 . . . . 0.0 113.202 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.656 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.0 OUTLIER -177.48 -46.5 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.436 178.971 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.617 HD21 HD22 ' A' ' 3' ' ' LEU . 27.1 mt -73.47 -40.65 63.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.789 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -76.95 -37.46 55.23 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 113.297 -1.774 . . . . 0.0 108.161 176.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.656 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -52.32 -20.07 2.5 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.029 178.322 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.911 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.1 OUTLIER -71.63 43.96 0.09 Allowed 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 125.172 1.389 . . . . 0.0 112.21 179.323 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -86.73 -58.72 2.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.938 179.537 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -98.02 22.57 9.19 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.261 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.776 ' HB2' HD11 ' B' ' 15' ' ' LEU . 0.5 OUTLIER -103.15 -84.68 0.46 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.663 179.75 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.666 ' HB2' HD13 ' B' ' 15' ' ' LEU . . . -49.0 -41.75 35.51 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.018 0.527 . . . . 0.0 111.185 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 mtt-85 -64.35 -67.77 0.41 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.965 0.412 . . . . 0.0 111.078 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -32.65 44.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.969 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' B' ' 18' ' ' MET . 37.8 mt-10 -82.66 -17.15 45.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.945 179.747 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.09 9.41 86.97 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -177.301 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 95.3 mt -88.62 171.48 10.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.555 0.742 . . . . 0.0 111.769 -179.445 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 87.5 p -110.53 163.34 13.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.074 177.578 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -43.25 -38.55 2.62 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.214 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.718 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 69.5 m -83.2 -52.14 6.85 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.631 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.46 ' HB3' HD21 ' B' ' 24' ' ' LEU . 3.9 mm-40 -65.44 -11.58 44.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.132 0.491 . . . . 0.0 110.562 178.916 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.911 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.9 tpt -81.59 -45.25 16.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 177.306 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.621 ' CG2' HD12 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -74.52 -25.79 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.689 0 CA-C-N 112.58 -2.1 . . . . 0.0 112.872 -178.13 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.538 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.45 -50.37 69.99 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.842 0.829 . . . . 0.0 109.282 177.508 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.538 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 14.0 p -74.44 -31.26 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.788 -1.551 . . . . 0.0 113.572 -176.868 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.806 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -53.96 -38.41 64.95 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 122.121 0.962 . . . . 0.0 109.235 177.469 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.637 HD23 HD23 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -77.77 -41.29 38.01 Favored 'General case' 0 N--CA 1.399 -3.009 0 CA-C-N 113.878 -1.51 . . . . 0.0 110.738 -178.768 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . 0.565 ' N ' ' CD1' ' B' ' 34' ' ' LEU . 5.5 mt-30 -57.12 -62.19 1.93 Allowed 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.186 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.806 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.9 p-80 -53.33 -32.51 49.37 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.854 1.206 . . . . 0.0 110.778 179.695 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.772 ' HB2' ' NE2' ' A' ' 36' ' ' HIS . 62.8 t80 -61.94 160.01 13.08 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.306 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.59 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 10.5 mmmt . . . . . 0 C--O 1.248 0.987 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.85 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.591 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.018 0.437 . . . . 0.0 111.828 . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -114.94 114.6 25.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.132 177.691 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -131.98 154.98 48.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.421 -178.866 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -124.38 131.55 53.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.788 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.663 HD12 ' HA ' ' B' ' 27' ' ' SER . 4.1 pt -146.02 176.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.364 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.0 t-105 -97.88 97.76 9.23 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.155 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.648 HD11 HG21 ' B' ' 30' ' ' ILE . 1.5 mm? -121.68 112.16 18.07 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 177.08 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.452 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.4 p -80.16 -145.94 0.05 OUTLIER 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 120.786 0.327 . . . . 0.0 111.411 -178.647 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -75.87 -159.82 0.12 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.953 -179.087 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.421 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 tt0 36.11 44.87 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.487 0.715 . . . . 0.0 112.62 179.048 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.713 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 12.4 t -176.01 -43.98 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.087 179.167 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 8' ' ' SER . 27.8 mt -71.03 -42.28 69.74 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 175.943 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -68.15 -39.5 82.63 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 113.286 -1.779 . . . . 0.0 107.521 176.017 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.713 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.1 t70 -50.21 -36.33 30.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.274 178.803 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.753 HD21 ' SD ' ' A' ' 29' ' ' MET . 51.3 mt -66.82 6.08 0.54 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -69.16 -61.93 1.59 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.228 -0.295 . . . . 0.0 110.687 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.541 ' HA ' ' HB2' ' A' ' 21' ' ' ARG . 1.1 mttm -77.92 -11.3 59.88 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.87 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 9.6 mtm -93.95 -29.57 15.19 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.261 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.758 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -103.98 -64.49 1.1 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.917 -0.129 . . . . 0.0 111.214 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 -57.94 -63.71 1.16 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.149 0.5 . . . . 0.0 111.791 -179.61 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.541 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -51.78 -31.02 25.33 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.483 179.609 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.505 ' HB2' ' O ' ' A' ' 18' ' ' MET . 20.0 mm-40 -92.66 -6.12 49.99 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.389 179.989 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.59 -3.51 78.25 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 120.618 -0.801 . . . . 0.0 111.992 -178.58 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.758 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.7 mt -75.27 171.49 14.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.561 0.696 . . . . 0.0 111.482 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 96.0 p -118.32 163.11 17.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.59 -1.187 . . . . 0.0 109.674 178.622 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.436 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -39.43 -37.84 0.5 Allowed 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.532 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.603 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 3.4 m -83.98 -56.88 3.44 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.425 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HB3' HD21 ' A' ' 24' ' ' LEU . 3.1 mt-10 -61.87 -9.66 7.37 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.675 0.274 . . . . 0.0 110.437 179.017 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.87 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.6 tpt -85.64 -48.34 8.97 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 122.742 1.258 . . . . 0.0 108.057 178.083 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.654 HG23 ' CD1' ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.03 -39.87 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 112.887 -1.96 . . . . 0.0 112.873 -177.796 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.71 -46.25 91.11 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 122.215 1.007 . . . . 0.0 108.647 177.462 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.1 t -59.36 -43.11 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 CA-C-N 113.155 -1.838 . . . . 0.0 110.509 179.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.615 ' HB1' ' HB1' ' B' ' 33' ' ' ALA . . . -55.34 -33.33 63.27 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.543 178.466 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.657 HD21 ' CB ' ' B' ' 33' ' ' ALA . 14.2 mt -77.68 -30.15 51.81 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.044 -178.747 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -80.1 -17.04 53.65 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.244 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -110.59 15.15 22.22 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 178.735 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.48 -166.29 0.1 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 122.942 0.497 . . . . 0.0 109.956 178.823 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.554 ' HD3' ' N ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.489 1.516 . . . . 0.0 112.606 -178.091 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.375 0.131 . . . . 0.0 111.291 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -84.79 121.25 27.43 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.786 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.3 mm? -137.36 153.19 50.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 -179.549 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -115.88 130.57 56.89 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.572 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.654 ' CD1' HG23 ' A' ' 30' ' ' ILE . 4.4 pt -142.4 172.63 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.661 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.603 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 73.2 t-105 -99.6 104.61 16.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -177.446 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 0.6 OUTLIER -132.39 114.66 14.61 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.554 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.591 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 10.4 p -77.26 -173.55 2.88 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.636 0.732 . . . . 0.0 112.702 -177.954 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -48.29 -62.93 1.23 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.336 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.69 -28.71 9.55 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.551 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.596 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 74.1 p -86.33 -32.2 21.14 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.713 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' B' ' 8' ' ' SER . 52.2 mt -71.33 -39.91 71.08 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 177.916 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -62.44 -41.67 98.9 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 113.469 -1.696 . . . . 0.0 107.793 175.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.636 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.7 OUTLIER -54.48 -47.54 72.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.205 178.876 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.632 HD21 ' CG ' ' B' ' 29' ' ' MET . 15.2 mt -74.75 27.65 0.09 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.401 ' H ' ' C ' ' B' ' 14' ' ' ASP . 3.4 mm-40 -109.15 -55.3 2.43 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.87 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.83 -36.95 41.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.498 178.581 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.704 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 13.6 mtm -73.23 -16.82 61.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.455 178.58 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.807 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.93 -69.17 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.44 -179.485 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -69.41 0.21 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.966 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.46 -32.08 7.26 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.834 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.704 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 2.9 mt-10 -83.86 -24.36 30.9 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.386 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.431 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 99.18 64.04 0.84 Allowed Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.224 -0.988 . . . . 0.0 113.916 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.807 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -179.11 -177.62 0.48 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 177.77 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 25' ' ' SER . . . . . 0.542 ' N ' HD22 ' B' ' 24' ' ' LEU . 3.5 t -114.94 174.78 5.8 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.667 -179.149 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.45 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 0.0 OUTLIER -43.84 -38.92 3.56 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.083 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.663 ' HA ' HD12 ' A' ' 5' ' ' ILE . 3.2 p -80.3 -56.0 4.51 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 117.523 0.147 . . . . 0.0 111.351 -179.552 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.678 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.4 mm-40 -62.93 -11.8 21.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.555 0.217 . . . . 0.0 110.534 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.632 ' CG ' HD21 ' B' ' 15' ' ' LEU . 2.1 tpt -81.97 -47.6 12.5 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 122.699 1.238 . . . . 0.0 107.736 177.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.648 HG21 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -74.31 -37.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.11 0 CA-C-N 112.894 -1.957 . . . . 0.0 112.944 -177.846 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -61.57 -48.38 81.23 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 122.26 1.029 . . . . 0.0 108.543 176.9 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -58.04 -41.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 CA-C-N 113.015 -1.902 . . . . 0.0 111.561 -179.436 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.657 ' CB ' HD21 ' A' ' 34' ' ' LEU . . . -53.16 -37.61 62.03 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.902 179.194 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.567 HD22 ' CB ' ' A' ' 33' ' ' ALA . 15.4 mt -75.56 -31.97 60.23 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.774 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -77.82 -17.79 57.05 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.516 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -96.23 -35.28 11.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 121.259 -0.176 . . . . 0.0 110.99 177.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.54 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 13.4 t80 -40.89 143.09 0.4 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.651 0.38 . . . . 0.0 111.091 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt . . . . . 0 C--O 1.251 1.139 0 C-N-CA 123.587 0.755 . . . . 0.0 112.299 179.035 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.68 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.5 mpt_? . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.917 0.389 . . . . 0.0 111.518 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 87.9 m95 -104.68 116.35 31.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.001 178.745 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -133.21 157.4 45.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.72 -179.57 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.991 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -113.88 138.41 50.34 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.783 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.558 ' CD1' ' HB2' ' A' ' 7' ' ' LEU . 2.3 pp -154.69 167.5 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.37 0.605 . . . . 0.0 112.351 -178.589 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.496 ' O ' ' HB3' ' B' ' 27' ' ' SER . 68.0 t-105 -79.02 88.69 4.78 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.374 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.583 ' HG ' HD23 ' A' ' 12' ' ' LEU . 29.9 tp -125.83 84.62 2.29 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.938 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.579 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 47.9 p -63.41 175.39 1.02 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 122.248 1.023 . . . . 0.0 113.631 -177.067 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.99 -44.46 78.61 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 113.186 -1.825 . . . . 0.0 112.709 -179.35 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -40.54 -37.59 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.748 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.761 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.4 t -109.29 -11.03 14.92 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -178.859 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.583 HD23 ' HG ' ' A' ' 7' ' ' LEU . 66.5 mt -70.05 -38.44 75.82 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 175.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.89 -40.79 98.61 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.164 -1.835 . . . . 0.0 107.952 176.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.761 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -53.14 -42.99 66.6 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.461 178.497 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.684 HD11 HG12 ' A' ' 30' ' ' ILE . 28.9 mt -75.86 19.71 0.2 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -99.27 -50.24 4.19 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.28 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -81.37 -33.63 32.24 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.712 178.528 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.547 ' O ' ' HB3' ' A' ' 22' ' ' GLU . 25.0 mtm -67.65 -69.92 0.29 Allowed 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.092 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.757 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -37.27 -44.91 0.62 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.558 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -70.23 0.27 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.064 0.459 . . . . 0.0 111.309 -179.764 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -52.01 -27.43 13.52 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.573 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.601 ' CD ' HD13 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -86.11 -35.23 20.34 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.81 -179.874 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.538 ' O ' ' HB3' ' A' ' 24' ' ' LEU . . . 102.12 73.3 0.99 Allowed Glycine 0 C--N 1.342 0.863 0 C-N-CA 120.5 -0.857 . . . . 0.0 113.753 178.87 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.757 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER 169.46 -174.35 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 121.354 0.597 . . . . 0.0 112.346 177.962 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.06 169.42 8.45 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.67 -40.2 4.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -179.069 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.748 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 23.9 m -78.08 -56.47 4.45 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.589 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mt-10 -60.54 -18.71 54.02 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.055 0.455 . . . . 0.0 109.838 178.762 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.632 ' HG2' ' HB3' ' A' ' 15' ' ' LEU . 3.2 tpt -71.53 -47.86 52.5 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 123.122 1.439 . . . . 0.0 107.916 177.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.684 HG12 HD11 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -69.61 -28.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.614 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.155 -178.484 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.427 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -67.08 -49.39 65.19 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.937 0.875 . . . . 0.0 108.946 177.052 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.427 ' HA ' ' NE2' ' A' ' 35' ' ' GLN . 0.9 OUTLIER -57.4 -42.42 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.95 -179.905 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.721 ' CB ' HD21 ' B' ' 34' ' ' LEU . . . -50.87 -39.84 54.95 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.038 178.976 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.582 HD12 HD23 ' B' ' 15' ' ' LEU . 13.5 mt -73.45 -28.98 62.25 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.474 -178.32 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.427 ' NE2' ' HA ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -78.93 -19.76 50.99 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.08 -179.503 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.425 ' HD1' HG13 ' A' ' 32' ' ' VAL . 73.3 m80 -104.61 -35.89 7.67 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 178.281 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.583 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.3 t80 -30.79 130.87 0.1 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.0 0.52 . . . . 0.0 112.135 -179.753 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.437 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 117.993 -1.003 . . . . 0.0 112.07 177.956 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.579 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.802 0.334 . . . . 0.0 111.523 . . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -74.78 145.64 42.77 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.322 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.552 HD22 HD22 ' A' ' 12' ' ' LEU . 1.7 tp -158.05 150.63 22.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.165 -178.85 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.991 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.3 m -111.02 140.68 45.35 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.643 HD13 ' CG2' ' A' ' 30' ' ' ILE . 3.7 pt -148.41 179.8 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.98 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.748 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.3 t-105 -99.96 101.41 12.5 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -177.187 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.514 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -133.47 113.1 12.12 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 177.172 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.68 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -89.84 -165.83 1.44 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.415 0.626 . . . . 0.0 112.302 -178.132 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -47.79 -65.4 0.57 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.774 -178.476 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -49.3 -25.38 2.35 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.532 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.649 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 30.2 p -94.65 -38.89 10.62 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.552 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' B' ' 8' ' ' SER . 74.6 mt -63.93 -40.83 97.36 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 178.412 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.33 -43.18 98.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 113.747 -1.57 . . . . 0.0 107.975 176.298 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.649 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.71 -45.28 70.39 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.332 178.751 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.663 HD21 ' SD ' ' B' ' 29' ' ' MET . 18.0 mt -72.72 28.36 0.06 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.343 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 6.2 mm-40 -109.55 -56.28 2.32 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.16 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 1.1 mttm -75.86 -25.53 56.27 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 178.698 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.824 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.0 mtm -87.04 -23.35 25.0 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.208 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.684 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.34 -67.63 0.85 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.519 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -54.07 -67.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 4.8 mmm180 -49.01 -32.31 9.05 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.383 179.717 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.4 mm-40 -88.94 -6.64 57.13 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.466 179.808 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.42 -8.07 69.78 Favored Glycine 0 C--N 1.338 0.687 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.814 -178.526 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.684 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.6 mt -74.12 170.91 14.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.668 0.747 . . . . 0.0 111.605 -179.901 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.6 m -118.62 162.7 17.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.37 178.281 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.527 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -40.55 -37.46 0.71 Allowed 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -179.077 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.496 ' HB3' ' O ' ' A' ' 6' ' ' TRP . 0.7 OUTLIER -82.55 -57.56 3.29 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 122.697 0.399 . . . . 0.0 111.689 -179.538 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.442 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.2 mt-10 -61.69 -10.87 9.59 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.34 178.899 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.824 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.5 tpt -83.71 -47.86 10.74 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.769 1.271 . . . . 0.0 107.836 177.955 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.558 HG12 HD13 ' B' ' 15' ' ' LEU . 0.5 OUTLIER -73.64 -33.25 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.09 0 CA-C-N 112.791 -2.004 . . . . 0.0 113.147 -177.906 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.449 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -70.13 -48.7 56.4 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.94 0.876 . . . . 0.0 109.338 177.394 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.449 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.2 t -56.22 -40.3 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-N 113.499 -1.682 . . . . 0.0 110.642 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.68 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . . . -53.63 -32.68 52.33 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.482 179.005 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.721 HD21 ' CB ' ' A' ' 33' ' ' ALA . 11.3 mt -82.36 -32.83 29.09 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.78 -177.825 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -80.54 -8.42 59.57 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -112.17 8.21 19.81 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.488 0.185 . . . . 0.0 111.327 177.665 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.507 ' CD2' ' HD2' ' B' ' 38' ' ' LYS . 3.3 t80 -66.3 -169.29 0.07 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.085 0.554 . . . . 0.0 109.6 178.592 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.507 ' HD2' ' CD2' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.363 1.465 . . . . 0.0 112.915 -178.408 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 120.815 0.34 . . . . 0.0 111.864 . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -98.37 114.6 26.99 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.444 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 3.2 tp -122.25 142.39 50.51 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.266 -177.931 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.6 OUTLIER -123.76 128.77 50.05 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.663 178.217 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.573 HD12 ' CG2' ' B' ' 30' ' ' ILE . 1.1 pp -155.75 173.71 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -178.076 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -95.28 112.64 24.32 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -176.83 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.609 HD13 HG22 ' B' ' 30' ' ' ILE . 0.4 OUTLIER -129.52 122.65 29.65 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.519 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.8 p -80.31 -173.23 3.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.318 0.58 . . . . 0.0 110.412 -179.802 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.43 ' HA ' HD21 ' A' ' 12' ' ' LEU . 3.7 p-10 -61.93 -162.11 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.201 -178.645 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.449 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.54 40.43 0.12 Allowed 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.635 0.774 . . . . 0.0 112.805 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.717 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 2.0 t -179.78 -56.46 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.002 179.441 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.718 HD23 ' CD ' ' B' ' 1' ' ' ARG . 0.6 OUTLIER -62.61 -29.1 70.36 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 175.831 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.418 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 2.8 mm-40 -92.43 -37.5 12.52 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.609 -1.632 . . . . 0.0 108.692 177.201 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.717 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -45.34 -31.03 1.45 Allowed 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.718 179.472 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.692 HD12 HG12 ' A' ' 30' ' ' ILE . 43.8 mt -72.47 19.21 0.08 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 179.609 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -95.88 -48.6 5.66 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.217 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -84.63 -38.09 20.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.556 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.47 ' HA ' ' HB2' ' A' ' 22' ' ' GLU . 17.2 mtm -64.26 -72.69 0.14 Allowed 'General case' 0 C--N 1.341 0.239 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.427 179.466 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.75 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -28.5 -32.17 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.888 1.368 . . . . 0.0 113.934 -178.602 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.481 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 3.7 mmm180 -66.22 -121.2 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 119.729 -0.789 . . . . 0.0 110.35 179.194 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.38 -23.13 8.81 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 121.876 -0.515 . . . . 0.0 111.671 179.51 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.47 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 1.3 mp0 -109.07 -2.85 17.84 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -177.198 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.75 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -150.19 21.31 1.09 Allowed Glycine 0 C--O 1.221 -0.713 0 C-N-CA 115.766 -3.111 . . . . 0.0 117.693 -176.756 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.56 HD11 HG22 ' A' ' 32' ' ' VAL . 1.2 mp 51.31 -159.88 0.09 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 119.74 1.77 . . . . 0.0 113.353 175.63 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -60.82 165.21 4.15 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 114.282 -1.326 . . . . 0.0 110.373 178.535 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -43.87 66.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.311 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 m -80.71 -46.92 14.75 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.283 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.566 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 2.5 mm-40 -57.36 -27.49 62.33 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.591 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.727 ' SD ' ' HA3' ' A' ' 23' ' ' GLY . 4.2 tpt -63.61 -48.3 77.88 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 122.925 1.345 . . . . 0.0 109.109 177.702 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.692 HG12 HD12 ' A' ' 15' ' ' LEU . 0.3 OUTLIER -77.94 -29.78 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.582 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.128 -176.282 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -71.75 -50.02 33.83 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.052 0.929 . . . . 0.0 109.459 177.785 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.566 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.3 t -57.85 -42.86 83.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.817 -179.488 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.722 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -50.51 -27.71 7.12 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.625 179.154 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.68 HD11 HD23 ' B' ' 15' ' ' LEU . 10.9 mt -91.42 -30.91 16.24 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.922 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -75.7 -14.24 60.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.076 0.398 . . . . 0.0 112.076 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -111.04 35.6 3.48 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.491 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.586 ' CD2' ' N ' ' A' ' 38' ' ' LYS . 67.3 t80 -74.31 162.22 29.11 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.341 -178.735 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.586 ' N ' ' CD2' ' A' ' 37' ' ' TYR . 6.8 mmmt . . . . . 0 C--O 1.251 1.136 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.086 177.794 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.718 ' CD ' HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 120.785 0.326 . . . . 0.0 111.878 . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -89.56 122.46 32.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.834 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.506 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 mm? -133.61 151.07 51.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.958 0.409 . . . . 0.0 111.95 -178.605 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -123.78 124.25 42.28 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.257 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.557 HD13 HG22 ' A' ' 30' ' ' ILE . 3.8 pt -147.21 176.99 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.794 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 70.6 t-105 -96.9 101.82 13.48 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.268 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.574 HD13 HG21 ' A' ' 30' ' ' ILE . 0.7 OUTLIER -130.85 112.26 12.85 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.476 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.565 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 9.8 p -84.76 178.92 7.46 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.029 0.919 . . . . 0.0 113.028 -177.89 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -47.69 -49.15 28.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 113.321 -1.763 . . . . 0.0 112.781 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -43.46 -35.02 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.527 -178.846 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.729 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 3.9 t -112.28 -7.74 13.99 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -179.202 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' B' ' 8' ' ' SER . 73.8 mt -72.88 -38.96 66.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 175.762 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.54 -41.35 98.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.285 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.729 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -52.2 -43.05 64.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.622 178.794 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.76 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 16.5 mt -79.09 22.88 0.38 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.628 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -43.35 4.48 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -80.71 -46.91 14.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.301 0.24 . . . . 0.0 111.524 179.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.674 ' HG3' ' SD ' ' B' ' 29' ' ' MET . 0.4 OUTLIER -81.32 10.04 6.2 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.61 ' HB1' ' HB2' ' B' ' 29' ' ' MET . . . -111.04 -61.06 1.75 Allowed 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.542 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 29.9 mmm-85 -62.0 -63.51 1.23 Allowed 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.182 0.515 . . . . 0.0 111.505 179.191 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -34.56 35.35 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.844 179.534 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -80.48 -12.65 59.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.673 179.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.59 -12.91 68.69 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.76 -178.666 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.411 HD21 ' HB3' ' B' ' 28' ' ' GLU . 43.4 mt -74.26 175.3 7.72 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.907 0.86 . . . . 0.0 112.22 -179.793 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -118.33 173.29 6.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.166 178.139 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.56 -38.85 60.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 7.3 m -79.79 -52.66 7.64 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.539 0.209 . . . . 0.0 111.029 179.819 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.411 ' HB3' HD21 ' B' ' 24' ' ' LEU . 2.7 mm-40 -63.82 -13.52 45.25 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.262 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.76 ' HG2' ' HB3' ' B' ' 15' ' ' LEU . 1.2 tpt -80.84 -45.77 16.37 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 123.714 1.721 . . . . 0.0 107.176 177.129 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.635 HG12 ' CD1' ' B' ' 15' ' ' LEU . 0.5 OUTLIER -65.71 -17.91 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.772 0 CA-C-N 112.943 -1.935 . . . . 0.0 111.957 -179.099 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.411 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -80.34 -47.51 14.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.075 176.82 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.749 ' CG2' ' HE1' ' B' ' 29' ' ' MET . 0.1 OUTLIER -59.25 -30.94 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 CA-C-O 121.665 0.745 . . . . 0.0 108.996 178.549 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.995 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -37.42 -44.35 0.63 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 113.722 -1.581 . . . . 0.0 110.924 177.919 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.611 HD13 HD22 ' A' ' 15' ' ' LEU . 9.2 mt -83.78 -30.45 26.59 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.534 -179.392 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' B' ' 32' ' ' VAL . 13.2 mt-30 -82.89 -15.61 50.8 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.426 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.995 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 1.0 OUTLIER -118.3 6.06 11.89 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.974 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.722 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 1.0 OUTLIER -78.49 137.84 38.14 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.172 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.451 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 117.931 -1.033 . . . . 0.0 112.025 178.366 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.836 ' HD3' HD23 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 . . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -88.96 118.39 28.65 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.107 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 mm? -131.85 154.76 48.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.73 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -127.03 135.23 50.53 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 178.775 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.668 HD11 HD22 ' A' ' 7' ' ' LEU . 2.3 pp -151.12 171.86 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.898 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.589 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 73.2 t-105 -84.76 91.64 8.02 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.036 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.668 HD22 HD11 ' A' ' 5' ' ' ILE . 2.9 mp -131.45 98.68 4.59 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 177.038 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.795 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -74.07 -168.22 0.6 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.525 0.678 . . . . 0.0 112.127 -177.863 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -55.17 -54.39 43.88 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.478 -1.237 . . . . 0.0 113.078 -178.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -50.35 -22.58 1.89 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.461 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 15.7 p -96.72 -25.46 15.52 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.718 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 8' ' ' SER . 20.0 mt -78.8 -37.33 41.11 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 178.613 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.96 -41.29 78.04 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 174.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 18' ' ' MET . 0.1 OUTLIER -55.63 -47.44 76.59 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.683 177.421 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.765 ' HB3' ' HG2' ' A' ' 29' ' ' MET . 22.3 mt -81.32 31.56 0.34 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.829 179.657 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.412 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -113.78 -49.58 2.87 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.687 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.412 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 2.1 ptmm? -88.83 -28.8 20.16 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.613 0.365 . . . . 0.0 111.056 178.577 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.583 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 6.9 mtm -87.04 -8.17 57.38 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.567 178.743 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.83 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -89.69 -18.99 25.37 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.063 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.28 -134.77 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.863 -179.485 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.36 -22.5 1.14 Allowed 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.552 -0.717 . . . . 0.0 110.199 178.274 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.509 ' HB3' ' OH ' ' B' ' 37' ' ' TYR . 1.8 mp0 -90.9 -22.14 21.06 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -178.526 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.83 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -139.2 17.97 3.13 Favored Glycine 0 CA--C 1.504 -0.646 0 C-N-CA 117.313 -2.375 . . . . 0.0 116.702 -176.736 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.571 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER 53.75 -163.26 0.11 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 118.679 1.24 . . . . 0.0 114.212 174.953 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.66 163.33 3.32 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 113.727 -1.579 . . . . 0.0 110.593 178.692 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -51.13 -43.81 61.24 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.801 0.296 . . . . 0.0 111.801 -179.474 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -77.08 -39.59 49.19 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.543 0.211 . . . . 0.0 111.023 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.571 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.8 mt-10 -64.81 -36.45 84.37 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.282 179.508 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.765 ' HG2' ' HB3' ' A' ' 15' ' ' LEU . 2.4 tpt -61.3 -44.66 96.84 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 123.96 1.838 . . . . 0.0 108.407 177.445 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.757 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -68.28 -18.6 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 112.97 -1.923 . . . . 0.0 112.265 -177.543 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.14 -45.23 16.72 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.168 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.742 ' CG2' ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -60.39 -32.33 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.467 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 1.015 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.98 -42.0 1.3 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.163 -1.38 . . . . 0.0 110.536 177.83 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.696 ' HB3' ' HE1' ' B' ' 18' ' ' MET . 9.8 mt -83.12 -29.7 28.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.726 -179.674 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.444 ' N ' ' O ' ' A' ' 32' ' ' VAL . 8.5 mt-30 -87.67 -18.62 29.15 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.489 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 1.015 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -109.44 4.52 22.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.418 0.554 . . . . 0.0 112.412 179.687 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.593 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.9 t80 -79.85 145.61 32.65 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.661 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.475 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.729 -0.653 . . . . 0.0 112.245 179.48 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.795 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.908 0.385 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . 0.474 ' O ' ' HD3' ' B' ' 1' ' ' ARG . 99.2 m95 -69.26 174.84 4.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.697 179.896 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.528 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 tp -169.14 137.38 1.95 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 1.0 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -117.16 138.69 51.5 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.683 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.757 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.3 pp -161.81 173.63 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.222 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.7 t-105 -93.0 114.25 26.75 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.463 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.649 ' CD1' HG23 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -128.97 123.78 33.34 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.561 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.441 ' O ' HD22 ' B' ' 12' ' ' LEU . 11.6 p -81.5 -174.24 4.85 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.839 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.403 ' HA ' HD21 ' B' ' 12' ' ' LEU . 3.0 p-10 -63.3 -163.55 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.808 -178.827 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 35.37 41.75 0.09 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.447 0.699 . . . . 0.0 112.723 179.014 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.644 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 0.7 OUTLIER -178.38 -56.15 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.998 179.678 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.836 HD23 ' HD3' ' A' ' 1' ' ' ARG . 1.0 OUTLIER -61.97 -30.38 70.89 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.445 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -95.46 -35.87 11.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.06 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.644 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 6.6 t70 -44.69 -31.17 1.09 Allowed 'General case' 0 C--N 1.343 0.306 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.217 179.779 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.668 HD11 HG12 ' B' ' 30' ' ' ILE . 44.2 mt -67.64 14.69 0.05 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -83.23 -42.11 17.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.262 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.44 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 5.1 mtpm? -91.37 -21.62 20.9 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.368 179.009 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.833 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 2.6 mtm -83.98 -26.51 29.14 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.586 -179.731 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.725 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.22 -69.51 0.76 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.637 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.487 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -53.16 -67.82 0.22 Allowed 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.35 -33.71 14.13 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.365 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.565 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.3 mm-40 -85.5 -11.2 54.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.16 179.703 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.94 -9.1 78.42 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.624 -178.219 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.725 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 60.3 mt -75.76 177.77 6.63 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 121.543 0.687 . . . . 0.0 111.52 179.963 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.1 p -124.51 170.41 10.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.403 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 0.0 OUTLIER -44.98 -40.59 6.56 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.523 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.589 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 3.8 p -85.83 -51.37 6.45 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -179.802 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.564 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.9 mm-40 -64.04 -4.18 3.24 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 121.388 -0.125 . . . . 0.0 111.292 179.579 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.833 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 3.5 tpt -94.33 -50.3 5.31 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 177.666 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.668 HG12 HD11 ' B' ' 15' ' ' LEU . 0.7 OUTLIER -73.59 -36.66 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.911 0 CA-C-N 113.311 -1.768 . . . . 0.0 112.677 -178.426 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.428 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.62 -48.94 65.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.941 0.877 . . . . 0.0 109.441 177.344 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.564 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -59.92 -36.79 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.376 -179.851 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.593 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -50.74 -32.47 19.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.105 179.209 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.588 ' CD1' HD22 ' A' ' 15' ' ' LEU . 13.4 mt -90.64 -28.92 18.07 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.557 -177.634 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -68.92 -19.66 64.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.49 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -102.84 25.71 8.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.863 0.363 . . . . 0.0 110.382 177.101 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.68 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 1.4 t80 -103.8 144.49 31.42 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.667 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.68 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 2.1 mppt? . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.191 178.159 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.743 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.8 mpt_? . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 120.921 0.391 . . . . 0.0 111.661 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -100.19 121.19 41.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.48 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.504 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -132.44 137.07 47.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.49 -178.63 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 1.003 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -119.34 128.39 54.07 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.553 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.575 HG13 ' CD2' ' A' ' 7' ' ' LEU . 4.1 pt -151.29 -178.86 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.231 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.415 ' O ' ' HB2' ' B' ' 27' ' ' SER . 76.2 t-105 -93.52 96.39 9.84 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -177.097 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.688 HD13 HG23 ' B' ' 30' ' ' ILE . 1.4 mm? -121.54 117.73 27.5 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 176.39 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.609 ' C ' HD23 ' A' ' 12' ' ' LEU . 50.7 p -65.84 165.93 12.04 Favored 'General case' 0 N--CA 1.427 -1.589 0 CA-C-O 122.21 1.005 . . . . 0.0 111.283 -178.336 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.557 ' HA ' HD23 ' A' ' 12' ' ' LEU . 5.8 t70 -60.65 -35.74 76.96 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 113.237 -1.801 . . . . 0.0 113.077 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -71.37 32.25 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.629 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.72 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -171.18 -50.26 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 122.881 0.472 . . . . 0.0 111.787 178.618 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.782 ' CD2' ' HD2' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -56.3 -29.83 61.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.836 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.452 ' HG3' ' CG ' ' A' ' 9' ' ' ASP . 3.0 mm-40 -88.28 -38.24 15.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.321 -1.309 . . . . 0.0 108.571 177.393 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.72 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 4.7 t70 -44.72 -24.45 0.2 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.214 178.158 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.679 ' HB3' ' HG2' ' A' ' 29' ' ' MET . 50.1 mt -67.51 14.6 0.05 Allowed 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.325 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.8 mt-10 -87.01 -44.62 11.45 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.424 ' HG2' ' NH2' ' A' ' 21' ' ' ARG . 18.2 mttp -79.5 -22.77 43.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.067 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.941 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 5.0 mtm -90.25 -23.61 21.18 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.047 -179.167 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.732 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -102.3 -65.87 0.96 Allowed 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.4 mtp85 -55.41 -67.7 0.26 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.013 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.424 ' NH2' ' HG2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -50.27 -30.84 12.71 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.227 179.917 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 18' ' ' MET . 7.2 mm-40 -88.66 -7.39 56.43 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.499 179.958 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.98 -9.55 68.8 Favored Glycine 0 C--N 1.34 0.793 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.127 -179.114 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.732 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 68.2 mt -73.07 178.47 4.35 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.508 0.671 . . . . 0.0 111.301 179.92 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -124.91 172.31 9.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.916 178.755 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.456 ' HB3' ' CG2' ' B' ' 5' ' ' ILE . 0.6 OUTLIER -46.15 -39.8 10.14 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.139 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.674 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 1.3 p -87.87 -50.18 6.61 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.447 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.4 mt-10 -63.58 -6.32 5.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.624 0.249 . . . . 0.0 110.484 178.96 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.941 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.4 tpt -89.73 -50.01 6.31 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-O 122.562 1.173 . . . . 0.0 107.983 178.075 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.634 HG12 HD12 ' A' ' 15' ' ' LEU . 0.5 OUTLIER -73.77 -38.57 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.064 0 CA-C-N 113.202 -1.817 . . . . 0.0 112.444 -178.004 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.407 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -61.88 -46.76 88.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 122.091 0.948 . . . . 0.0 108.56 176.684 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.85 -41.22 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.219 -179.979 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.523 ' CB ' HD21 ' B' ' 34' ' ' LEU . . . -53.36 -34.79 58.98 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.656 178.915 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.646 HD23 ' HB3' ' B' ' 33' ' ' ALA . 10.3 mt -79.38 -29.07 41.91 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.256 -178.874 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -79.16 -16.98 55.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.785 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.9 m80 -102.95 2.61 35.34 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.594 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.663 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 1.9 t80 -67.4 -168.95 0.09 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.543 0.337 . . . . 0.0 111.078 179.718 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.45 ' CD ' ' C ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 C-N-CA 125.866 1.666 . . . . 0.0 112.818 -178.535 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.782 ' HD2' ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.819 0.343 . . . . 0.0 111.145 . . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.84 130.57 41.37 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.057 0.456 . . . . 0.0 110.941 -179.266 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -130.57 142.93 50.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.542 -178.859 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 1.003 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -127.87 132.84 49.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.739 179.108 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.551 ' CD1' HG13 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -150.27 -175.28 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.465 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.674 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 76.6 t-105 -103.79 92.32 4.37 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -177.252 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.628 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.6 OUTLIER -128.45 112.9 14.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.412 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.743 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.2 OUTLIER -86.35 -164.99 1.13 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.764 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -45.27 -66.46 0.4 Allowed 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.067 -1.424 . . . . 0.0 113.691 -178.044 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -47.88 -22.07 0.51 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.275 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.588 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 28.9 p -101.26 -35.5 9.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.433 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' B' ' 8' ' ' SER . 55.1 mt -69.7 -41.06 75.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 178.475 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -60.91 -41.86 96.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.84 -1.527 . . . . 0.0 107.442 175.858 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.602 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.3 OUTLIER -51.83 -39.28 58.55 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.172 178.367 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.664 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 27.0 mt -78.38 29.91 0.18 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.412 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -104.47 -59.51 1.73 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.452 ' HG3' ' N ' ' B' ' 18' ' ' MET . 6.7 pttm -71.32 -21.73 62.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.72 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.842 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 7.5 mtm -91.17 -18.45 24.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.193 -179.866 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.712 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -103.19 -67.15 0.9 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.909 179.101 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -59.98 -66.29 0.54 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 120.914 0.388 . . . . 0.0 112.034 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.7 -33.25 15.39 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' B' ' 18' ' ' MET . 6.8 mm-40 -85.87 -10.83 54.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.351 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.58 -10.75 73.64 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.9 -178.681 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.712 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 57.4 mt -71.99 177.26 4.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.606 0.717 . . . . 0.0 111.561 179.779 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 37.5 p -123.44 168.04 13.06 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.46 178.784 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.19 -40.82 5.34 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.357 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.564 ' HA ' HD13 ' A' ' 5' ' ' ILE . 2.2 p -83.68 -51.49 7.22 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.445 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.9 mm-40 -63.64 -7.21 6.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.654 0.264 . . . . 0.0 110.816 178.878 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.842 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.7 tpt -89.18 -49.47 6.72 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 177.781 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.688 HG23 HD13 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -72.35 -27.95 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.288 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.696 -178.335 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.444 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.83 -52.36 37.75 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.627 0.727 . . . . 0.0 109.785 177.204 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.444 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 10.0 p -63.88 -32.65 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.819 -177.392 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.848 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -49.36 -32.05 10.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.892 177.437 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.662 ' CD1' HD22 ' A' ' 15' ' ' LEU . 14.4 mt -88.72 -26.64 21.68 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.159 -177.121 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.84 -27.51 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -177.614 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.848 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 6.4 p-80 -89.43 -33.47 16.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.963 0.801 . . . . 0.0 111.022 177.627 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.429 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 20.4 t80 -35.89 144.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.998 0.519 . . . . 0.0 111.877 -179.533 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt . . . . . 0 C--O 1.25 1.101 0 C-N-CA 123.611 0.765 . . . . 0.0 112.178 178.938 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.534 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 111.652 0.242 . . . . 0.0 111.652 . . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -71.54 123.57 22.75 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.713 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.511 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.2 tp -122.1 132.66 54.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.655 -178.589 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -117.7 117.92 30.66 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.126 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.678 HD11 ' HA ' ' B' ' 27' ' ' SER . 5.5 pt -143.26 176.42 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.827 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.4 t-105 -98.74 105.25 17.37 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -177.025 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.674 HD12 HG23 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -128.7 123.63 33.57 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.781 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.508 ' O ' ' HB3' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -86.29 -163.48 0.89 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.171 -179.555 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.435 ' O ' HG23 ' A' ' 11' ' ' THR . 3.1 t70 -63.61 -165.14 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.381 -177.949 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.5 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.7 tt0 36.83 40.68 0.15 Allowed 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.543 0.737 . . . . 0.0 112.761 179.307 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.684 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 11.2 t 177.39 -51.21 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.274 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.716 HD22 ' HB2' ' B' ' 1' ' ' ARG . 0.5 OUTLIER -68.44 -30.19 69.01 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.516 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.78 -40.16 12.66 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 113.745 -1.57 . . . . 0.0 107.706 177.577 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.684 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -44.17 -28.88 0.55 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.803 179.266 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.626 HD23 ' CD1' ' B' ' 34' ' ' LEU . 34.9 mt -69.2 20.21 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.424 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -97.18 -44.32 6.99 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.674 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 21.7 mtpp -87.73 -26.86 22.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.77 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 7.6 mtm -82.39 -14.5 55.11 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.959 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.773 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -100.63 -64.66 1.02 Allowed 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.525 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 -61.53 -69.86 0.22 Allowed 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -178.838 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 13.2 mmp_? -50.38 -29.8 10.84 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.929 -179.966 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.629 ' HG3' ' HA ' ' A' ' 18' ' ' MET . 4.3 mm-40 -84.57 -26.6 27.86 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -179.639 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.75 67.34 0.95 Allowed Glycine 0 C--N 1.337 0.615 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.771 178.585 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.773 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -176.94 179.5 1.04 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.099 0.475 . . . . 0.0 111.587 177.562 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.419 ' N ' HD21 ' A' ' 24' ' ' LEU . 84.5 p -100.19 165.54 11.44 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.414 -178.791 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.429 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 1.1 mmmm -48.23 -35.72 12.46 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.614 ' HA ' HD13 ' B' ' 5' ' ' ILE . 1.5 m -78.55 -58.33 3.3 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 122.239 0.216 . . . . 0.0 110.781 179.88 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.478 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.0 mm-40 -57.77 -16.84 12.52 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 178.431 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.77 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 0.8 OUTLIER -75.42 -50.33 16.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 122.621 1.2 . . . . 0.0 108.115 177.86 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.584 HG21 HD12 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -70.63 -34.17 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.122 0 CA-C-N 113.007 -1.906 . . . . 0.0 113.069 -177.697 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.456 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.79 -49.03 67.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.046 0.927 . . . . 0.0 108.794 177.023 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.478 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -54.93 -42.1 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.626 -179.702 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.629 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -46.75 -36.15 6.93 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.188 179.367 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.703 HD22 ' HB3' ' B' ' 33' ' ' ALA . 10.5 mt -77.56 -37.1 51.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.009 -178.081 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.22 -17.05 62.52 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.484 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -107.02 27.23 9.21 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 177.142 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.745 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 9.8 t80 -117.08 146.7 42.95 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.667 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.589 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.1 0 C-N-CA 123.74 0.816 . . . . 0.0 112.117 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.716 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.159 0.504 . . . . 0.0 111.944 . . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -101.87 117.48 34.94 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.953 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.537 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 15.8 tp -108.12 132.88 53.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.531 -177.966 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 1.001 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -126.91 119.36 26.55 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.212 178.442 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.614 HD13 ' HA ' ' A' ' 27' ' ' SER . 1.0 OUTLIER -152.65 -178.23 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.363 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -93.49 91.48 7.15 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -177.726 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.633 ' HB3' HG21 ' B' ' 11' ' ' THR . 2.1 mm? -128.75 104.14 7.46 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.429 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.534 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 8.8 t -69.66 -135.71 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.891 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.416 ' C ' ' H ' ' B' ' 11' ' ' THR . 13.3 t70 -90.23 -38.76 13.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -177.631 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . 0.574 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 1.4 mt-30 -73.59 41.83 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.087 0.47 . . . . 0.0 111.717 -179.181 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.717 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 1.1 t -165.27 -37.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 178.826 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.532 ' N ' HG22 ' B' ' 11' ' ' THR . 15.4 mt -79.87 -42.87 23.33 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.112 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.35 -30.25 22.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.619 177.576 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.717 ' HB2' ' N ' ' B' ' 11' ' ' THR . 5.6 t70 -41.99 -19.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.002 -1.454 . . . . 0.0 113.333 -179.052 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.782 ' HB2' ' HG3' ' B' ' 18' ' ' MET . 0.0 OUTLIER -137.14 56.02 1.8 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 179.272 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.58 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 4.1 mt-10 -56.57 -25.27 51.84 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.929 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.656 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 9.1 mttp -84.68 -45.07 12.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.948 179.399 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.782 ' HG3' ' HB2' ' B' ' 15' ' ' LEU . 20.3 mtm -59.09 -25.89 64.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.796 0.331 . . . . 0.0 110.591 179.614 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.67 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -100.91 -64.82 1.01 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.352 179.581 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 2.9 mtp85 -67.06 -65.14 0.72 Allowed 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.112 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . 0.656 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.96 -34.33 20.51 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.512 -179.859 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.498 ' HB2' ' O ' ' B' ' 18' ' ' MET . 8.8 mm-40 -82.43 -14.53 54.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.017 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.9 -5.98 83.06 Favored Glycine 0 C--N 1.339 0.707 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.702 -178.546 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.67 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 76.6 mt -71.8 177.57 4.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 111.681 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 25' ' ' SER . . . . . 0.469 ' O ' ' HB3' ' B' ' 29' ' ' MET . 25.1 p -119.0 169.33 9.99 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.261 178.418 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.41 -37.66 17.61 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.678 ' HA ' HD11 ' A' ' 5' ' ' ILE . 6.0 p -87.02 -49.76 7.11 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.566 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.412 ' HB3' HD23 ' B' ' 24' ' ' LEU . 2.4 mm-40 -61.12 -11.62 9.45 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 121.046 -0.262 . . . . 0.0 111.019 179.686 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.72 ' C ' ' SD ' ' B' ' 29' ' ' MET . 0.0 OUTLIER -85.28 -43.05 14.08 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 176.748 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.674 HG23 HD12 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -78.99 -24.59 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-N 113.616 -1.629 . . . . 0.0 113.789 -176.942 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.523 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -66.26 -53.92 31.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.658 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.523 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 15.0 p -64.29 -32.6 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.673 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.333 -177.69 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.869 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -52.3 -27.97 17.26 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.651 177.195 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.629 HD23 ' CB ' ' A' ' 33' ' ' ALA . 13.4 mt -90.31 -27.15 19.61 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.416 -178.374 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -69.18 -37.25 78.06 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -178.049 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.869 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 4.5 p-80 -81.77 -41.45 21.16 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 118.952 0.796 . . . . 0.0 110.772 178.309 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.499 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 28.3 t80 -48.48 150.24 1.4 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.907 -179.42 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 117.947 -1.025 . . . . 0.0 112.3 178.172 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.658 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.096 0.474 . . . . 0.0 111.914 . . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -110.36 117.21 33.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 177.353 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.516 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -127.8 140.93 51.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.725 -177.883 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -120.73 129.87 53.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.414 178.624 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.642 HD12 ' HA ' ' B' ' 27' ' ' SER . 0.8 OUTLIER -150.85 -176.94 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.5 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 70.9 t-105 -92.69 94.79 9.19 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.591 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.579 HD13 HG21 ' B' ' 30' ' ' ILE . 1.8 mm? -130.36 105.44 7.89 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.3 177.76 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 51.8 p -67.7 -139.18 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.582 0.229 . . . . 0.0 110.941 -178.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -99.0 -142.64 0.32 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 119.558 -0.258 . . . . 0.0 111.386 -179.191 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 33.38 42.11 0.04 OUTLIER 'General case' 0 C--N 1.346 0.445 0 C-N-CA 123.455 0.702 . . . . 0.0 112.67 179.401 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.656 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -176.34 -49.9 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.989 179.488 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.446 HD21 ' CD2' ' B' ' 3' ' ' LEU . 47.7 mt -71.22 -39.8 71.49 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 176.016 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -40.44 65.0 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 113.134 -1.848 . . . . 0.0 107.04 176.088 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.656 ' CB ' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -49.39 -27.46 4.09 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 113.497 -1.683 . . . . 0.0 110.753 179.108 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.675 HD21 ' SD ' ' A' ' 29' ' ' MET . 74.3 mt -63.02 4.52 0.18 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -60.73 -59.04 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 179.49 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.4 pttp -85.76 -9.02 57.76 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.392 178.88 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.592 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 10.7 mtp -88.37 -23.46 23.37 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.944 179.48 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -101.35 -60.62 1.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.567 -179.796 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.6 mtp-105 -63.5 -68.08 0.37 Allowed 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 111.549 -179.716 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.41 -34.16 15.69 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.48 179.909 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.592 ' HB2' ' O ' ' A' ' 18' ' ' MET . 6.6 mm-40 -81.32 -28.2 34.68 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.08 -179.961 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.477 ' O ' ' HB3' ' A' ' 24' ' ' LEU . . . 97.91 68.92 0.95 Allowed Glycine 0 C--N 1.339 0.724 0 C-N-CA 120.394 -0.907 . . . . 0.0 113.135 179.505 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.81 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER 177.02 -178.49 0.17 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.153 0.501 . . . . 0.0 111.748 178.146 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.464 ' O ' ' N ' ' A' ' 29' ' ' MET . 0.7 OUTLIER -110.69 166.88 10.66 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.865 -178.696 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.428 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -38.11 -43.29 0.73 Allowed 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -179.271 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.596 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 4.4 m -78.45 -53.39 7.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.733 0.242 . . . . 0.0 111.295 -179.27 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.61 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mt-10 -64.37 -15.2 60.0 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 110.023 178.605 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.675 ' SD ' HD21 ' A' ' 15' ' ' LEU . 2.5 tpt -77.09 -46.93 21.92 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.245 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.663 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.0 -25.92 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.788 0 CA-C-N 112.834 -1.985 . . . . 0.0 112.716 -178.586 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.562 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.44 -51.25 58.87 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.674 0.749 . . . . 0.0 109.241 177.395 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.562 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 12.3 p -66.97 -31.69 54.59 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.679 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.56 -177.866 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.704 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -44.9 -34.07 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.32 177.406 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.625 ' CD1' HD22 ' B' ' 15' ' ' LEU . 8.8 mt -95.75 -24.92 16.28 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -177.769 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -69.69 -39.76 76.76 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.858 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.731 ' CD2' ' HA ' ' B' ' 37' ' ' TYR . 0.3 OUTLIER -64.12 -34.73 78.71 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.237 0.926 . . . . 0.0 110.225 178.247 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.651 ' CD1' ' N ' ' A' ' 38' ' ' LYS . 0.9 OUTLIER -48.83 141.71 7.16 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.076 -179.629 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.651 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 177.193 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 120.899 0.38 . . . . 0.0 111.571 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -79.42 133.79 36.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.859 179.603 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.2 tp -133.41 144.85 49.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.516 -178.647 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.997 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.3 OUTLIER -128.92 130.3 46.61 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.71 179.077 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.663 ' CD1' HG21 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -150.34 -173.86 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.579 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.596 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 67.0 t-105 -97.91 101.6 13.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.485 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.501 HD12 HG22 ' A' ' 30' ' ' ILE . 1.6 mm? -128.27 107.0 9.41 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.499 178.113 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.658 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 11.1 p -79.99 -172.95 3.66 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 121.508 0.671 . . . . 0.0 112.103 -178.492 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -48.96 -58.07 5.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.967 -179.55 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -50.48 -30.79 13.59 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.021 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.637 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 44.2 p -87.57 -34.7 18.47 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.776 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' B' ' 8' ' ' SER . 50.2 mt -68.58 -39.82 80.8 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 178.394 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.11 -41.52 94.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.53 -1.668 . . . . 0.0 108.365 176.496 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.647 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.3 OUTLIER -52.57 -46.44 66.87 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.086 179.036 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.698 ' HB3' ' HG2' ' B' ' 29' ' ' MET . 23.9 mt -77.34 32.31 0.15 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.97 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -105.64 -55.7 2.29 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.226 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -82.13 -24.77 34.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.465 179.214 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.647 ' HG3' ' O ' ' B' ' 14' ' ' ASP . 8.0 mtm -85.08 -14.49 47.04 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.688 0.28 . . . . 0.0 110.451 179.294 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.83 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -99.92 -65.51 0.96 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.026 -179.891 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 22.3 mtp85 -58.56 -63.54 1.25 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.044 0.449 . . . . 0.0 111.502 -179.146 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.46 -34.75 17.59 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.549 179.381 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' B' ' 18' ' ' MET . 3.2 mm-40 -73.22 -28.64 62.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.145 178.907 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.65 -15.67 37.82 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.332 179.663 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.849 HD23 ' C ' ' B' ' 24' ' ' LEU . 0.0 OUTLIER -90.64 -172.51 3.42 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.197 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.1 p -114.28 170.73 8.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.699 -179.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.441 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 3.1 mttm -44.64 -39.77 5.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.428 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.642 ' HA ' HD12 ' A' ' 5' ' ' ILE . 13.2 m -71.94 -62.03 1.57 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.483 0.182 . . . . 0.0 110.906 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.663 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.6 mm-40 -57.95 -17.05 14.54 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.132 179.353 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.772 ' HB2' HD22 ' B' ' 24' ' ' LEU . 1.3 tpt -78.07 -45.78 22.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 123.601 1.667 . . . . 0.0 107.565 177.466 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.605 HG12 ' CD1' ' B' ' 15' ' ' LEU . 0.5 OUTLIER -67.73 -18.76 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.789 0 CA-C-N 112.845 -1.98 . . . . 0.0 112.21 -177.987 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.435 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -81.71 -44.96 16.37 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.67 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.767 ' HB ' ' CD2' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -60.41 -32.28 50.73 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.659 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.973 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -35.74 -40.04 0.17 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 113.656 -1.611 . . . . 0.0 110.967 178.325 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.656 ' CD1' HD22 ' A' ' 15' ' ' LEU . 4.0 mt -94.72 -28.38 15.34 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.259 -179.216 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' B' ' 32' ' ' VAL . 9.9 mt-30 -83.14 -30.13 28.1 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -179.375 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.973 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -94.3 19.43 9.48 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 117.909 0.322 . . . . 0.0 111.654 179.446 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.731 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -56.48 129.51 41.04 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -179.721 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.678 ' N ' ' HD1' ' B' ' 37' ' ' TYR . 1.4 mmmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 117.824 -1.084 . . . . 0.0 111.38 176.277 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 111.471 0.175 . . . . 0.0 111.471 . . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -80.58 113.13 18.56 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.465 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -122.95 141.33 52.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.058 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.992 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -116.96 128.73 55.49 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.975 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.602 HG13 HD22 ' A' ' 7' ' ' LEU . 1.9 pt -151.57 178.51 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.095 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -91.07 89.79 7.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -177.481 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.602 HD22 HG13 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -120.36 102.54 8.54 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.86 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.2 p -67.62 -140.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -177.061 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.435 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.6 t70 -95.28 -38.86 10.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.507 -178.011 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -72.55 39.45 0.08 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.946 0.498 . . . . 0.0 112.039 -179.153 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.778 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -163.59 -43.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.18 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.406 HD23 HD22 ' B' ' 3' ' ' LEU . 56.6 mt -68.12 -41.26 81.97 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.214 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.05 -38.46 90.91 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 113.416 -1.72 . . . . 0.0 107.917 176.07 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.778 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -51.78 -42.72 62.63 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.996 178.331 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.761 HD12 HG12 ' A' ' 30' ' ' ILE . 50.3 mt -73.31 -12.7 60.93 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.744 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.83 -42.31 71.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.62 0.247 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -92.93 -20.94 20.12 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.717 179.325 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.559 ' HA ' ' HB2' ' A' ' 22' ' ' GLU . 30.9 mtm -87.21 -61.31 1.75 Allowed 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -179.3 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.914 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -25.18 -34.5 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 114.214 1.191 . . . . 0.0 114.214 -178.48 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 18' ' ' MET . 31.3 mmm-85 -70.21 -113.88 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.797 179.643 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 mmm-85 -55.38 -24.42 29.69 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 122.703 0.401 . . . . 0.0 111.875 179.669 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.559 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 26.8 mm-40 -103.63 -19.57 14.3 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -177.85 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.914 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -115.36 -9.56 12.9 Favored Glycine 0 C--N 1.341 0.859 0 C-N-CA 119.127 -1.511 . . . . 0.0 114.624 -178.074 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.86 ' CD2' ' HB3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER 44.21 32.43 0.68 Allowed 'General case' 0 CA--C 1.556 1.195 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 177.508 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.674 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 1.9 t 131.68 163.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 127.707 2.403 . . . . 0.0 109.495 177.904 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -69.24 -48.18 62.64 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.577 179.824 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.6 m -77.95 -30.77 50.56 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.261 178.101 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.86 ' HB3' ' CD2' ' A' ' 24' ' ' LEU . 2.6 mm-40 -73.31 -28.47 62.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.743 179.091 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.727 ' HE3' HG22 ' A' ' 32' ' ' VAL . 3.4 tpt -67.87 -46.08 72.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 123.759 1.742 . . . . 0.0 107.896 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.761 HG12 HD12 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -65.75 -18.45 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.037 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.845 -179.371 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -50.33 11.35 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.144 177.084 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.795 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -55.4 -34.47 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 178.562 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.97 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -35.56 -46.56 0.41 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.558 -1.655 . . . . 0.0 111.556 178.056 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.664 HD11 HD22 ' B' ' 15' ' ' LEU . 6.2 mt -83.5 -32.82 25.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.868 -179.092 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -81.05 -11.74 59.46 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 179.478 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.97 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -123.29 -4.93 8.34 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -179.529 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.641 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.7 OUTLIER -62.6 142.17 58.15 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.847 0.459 . . . . 0.0 110.52 179.88 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.863 -1.065 . . . . 0.0 112.262 178.763 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.544 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -73.81 127.3 32.45 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.048 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.442 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.1 tp -134.48 137.82 44.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.629 -178.869 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.992 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -111.07 128.54 55.91 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.804 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.512 HG13 HD21 ' B' ' 7' ' ' LEU . 4.0 pt -150.62 176.19 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.446 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -94.58 104.12 16.06 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.612 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.676 HD13 HG22 ' A' ' 30' ' ' ILE . 1.3 mm? -124.08 115.48 21.24 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 176.976 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 28.0 p -73.86 -135.91 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.637 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.425 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 12.9 t70 -96.49 -39.79 9.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -177.755 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -72.29 41.31 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.72 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.606 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 4.7 t -160.57 -44.49 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.307 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.546 ' N ' HG22 ' B' ' 11' ' ' THR . 17.6 mt -73.79 -41.9 61.74 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.677 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' B' ' 9' ' ' ASP . 1.9 mt-10 -76.32 -37.98 56.63 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 113.555 -1.657 . . . . 0.0 108.366 176.472 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.606 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -48.8 -32.14 8.21 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.227 178.304 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.803 HD13 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -82.13 32.89 0.39 Allowed 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 124.654 1.182 . . . . 0.0 112.923 179.906 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.553 ' HG2' ' N ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -81.84 -41.92 20.37 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.995 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . 0.553 ' N ' ' HG2' ' B' ' 16' ' ' GLU . 24.0 mtpp -115.59 24.07 11.85 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.626 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.565 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 35.6 mtp -110.83 -75.53 0.62 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.397 0.141 . . . . 0.0 111.356 -179.831 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.682 ' HA ' ' CA ' ' B' ' 23' ' ' GLY . . . -25.46 -32.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.865 1.666 . . . . 0.0 114.131 -177.913 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' B' ' 18' ' ' MET . 0.0 OUTLIER -62.5 -141.46 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.476 -0.489 . . . . 0.0 109.699 177.944 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . 0.468 ' N ' ' CG ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -43.43 -21.94 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.577 -0.702 . . . . 0.0 112.279 179.043 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' B' ' 20' ' ' ARG . 19.5 mm-40 -104.42 -12.93 16.28 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -177.769 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.682 ' CA ' ' HA ' ' B' ' 19' ' ' ALA . . . -137.71 12.26 3.69 Favored Glycine 0 CA--C 1.501 -0.79 0 C-N-CA 116.804 -2.617 . . . . 0.0 116.962 -175.713 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' B' ' 19' ' ' ALA . 1.1 mp 53.55 -161.97 0.12 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 119.723 1.762 . . . . 0.0 112.622 177.038 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -64.14 158.85 21.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.438 178.895 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.48 -43.14 11.37 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 117.624 0.193 . . . . 0.0 111.509 -179.608 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -82.69 -50.28 8.89 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.883 -0.144 . . . . 0.0 111.078 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.475 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.2 mm-40 -54.07 -30.12 46.91 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.799 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.803 ' SD ' HD13 ' B' ' 15' ' ' LEU . 3.5 tpt -60.39 -47.58 85.45 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 122.82 1.295 . . . . 0.0 109.821 177.603 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.643 HG12 HD23 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -79.28 -29.47 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.43 0 CA-C-N 112.407 -2.179 . . . . 0.0 114.056 -175.341 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -70.58 -48.16 56.64 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.297 1.046 . . . . 0.0 108.931 177.079 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . 0.484 HG22 HD13 ' B' ' 24' ' ' LEU . 2.1 t -58.96 -47.07 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.469 -179.304 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.707 ' HB2' ' HB3' ' A' ' 33' ' ' ALA . . . -45.18 -34.81 2.91 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.804 179.686 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.577 HD13 HD22 ' A' ' 15' ' ' LEU . 13.6 mt -83.78 -30.46 26.58 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.398 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -80.36 -9.19 59.74 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.951 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -120.43 25.86 9.54 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 120.71 0.29 . . . . 0.0 111.153 177.961 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.596 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 22.1 t80 -132.96 163.55 28.94 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.744 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.595 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.5 tppt? . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.137 178.757 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.211 0.053 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -79.69 120.17 23.63 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.998 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 mm? -131.48 153.63 49.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.494 -178.995 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.989 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -126.65 127.56 45.37 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.329 178.829 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.622 HD12 ' HA ' ' B' ' 27' ' ' SER . 2.7 pt -145.32 176.49 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.446 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -96.2 95.06 7.87 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.156 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.615 HD13 HG22 ' B' ' 30' ' ' ILE . 1.3 mm? -124.9 108.23 11.69 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.298 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.0 p -72.37 -136.79 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.535 0.207 . . . . 0.0 111.07 -178.867 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -88.14 -156.46 0.36 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 119.798 -0.144 . . . . 0.0 110.932 -179.535 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.15 44.1 0.09 Allowed 'General case' 0 C--N 1.346 0.413 0 C-N-CA 123.229 0.611 . . . . 0.0 112.089 179.24 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.689 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 7.8 t -172.65 -46.45 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.714 179.673 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.408 ' H ' HG22 ' A' ' 11' ' ' THR . 34.5 mt -73.57 -42.58 61.44 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 175.774 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.96 -39.61 83.34 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 113.323 -1.762 . . . . 0.0 107.081 175.657 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.689 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.9 t70 -49.46 -30.69 8.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.015 -1.448 . . . . 0.0 110.415 178.581 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.73 HD23 ' SD ' ' A' ' 29' ' ' MET . 45.6 mt -73.51 22.73 0.07 Allowed 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.703 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -83.85 -66.1 0.93 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 122.17 -0.332 . . . . 0.0 110.551 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.75 -15.22 60.3 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.712 179.528 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.739 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 15.7 mtm -87.1 -27.37 23.16 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.37 -179.861 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.816 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -102.13 -59.38 1.71 Allowed 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.354 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.15 -62.21 1.93 Allowed 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 120.902 0.382 . . . . 0.0 111.601 -179.171 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.52 -36.15 22.36 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.513 179.439 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 18' ' ' MET . 12.1 mm-40 -76.21 -26.89 56.55 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.467 179.03 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.23 -12.85 61.93 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.18 -0.533 . . . . 0.0 112.359 -179.177 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.816 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -85.14 178.95 7.35 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.922 0.391 . . . . 0.0 111.9 -179.466 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.538 ' N ' HD23 ' A' ' 24' ' ' LEU . 19.3 p -113.76 169.6 8.87 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.779 -178.655 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.555 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -37.48 -42.4 0.51 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -179.385 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.673 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 29.2 p -72.42 -62.46 1.43 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.363 0.265 . . . . 0.0 111.586 -179.644 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.617 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mm-40 -58.56 -13.16 5.04 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.594 179.074 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.739 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.6 tpt -82.39 -48.25 11.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 122.736 1.255 . . . . 0.0 108.302 178.311 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.555 ' HB ' ' O ' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -74.51 -36.24 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.106 0 CA-C-N 112.806 -1.997 . . . . 0.0 112.916 -177.696 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.45 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -64.18 -47.04 81.37 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.136 0.969 . . . . 0.0 108.75 176.864 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.96 -42.3 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 113.239 -1.801 . . . . 0.0 111.422 -179.584 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.639 ' CB ' HD21 ' B' ' 34' ' ' LEU . . . -50.82 -42.27 58.26 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.443 179.622 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.678 HD13 HD23 ' B' ' 15' ' ' LEU . 9.4 mt -73.76 -34.32 64.65 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.617 -178.037 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -74.46 -13.57 60.72 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.451 ' HD1' HG13 ' A' ' 32' ' ' VAL . 60.1 m80 -107.85 -40.1 5.36 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 177.983 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.63 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.4 t80 -29.33 133.02 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.038 0.535 . . . . 0.0 111.963 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.458 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.058 178.147 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 1' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 . . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -78.97 122.37 26.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 178.963 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 3' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -130.57 152.5 49.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.334 -179.271 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 4' ' ' CYS . . . . . 0.989 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -125.67 128.31 47.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.532 178.956 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.501 HD11 HG22 ' A' ' 30' ' ' ILE . 2.3 pp -151.21 169.45 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-O 121.037 0.446 . . . . 0.0 112.118 -178.801 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.673 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 68.4 t-105 -81.19 90.51 6.08 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.74 0.781 . . . . 0.0 111.29 -179.594 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.59 ' HG ' ' CG2' ' B' ' 11' ' ' THR . 12.7 tp -107.17 95.39 5.68 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 178.537 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.57 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 6.0 p -81.34 -157.94 0.19 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.96 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . 0.404 ' C ' ' H ' ' B' ' 11' ' ' THR . 13.2 t70 -66.08 -41.57 90.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.913 -178.125 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -74.33 42.28 0.15 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.147 0.499 . . . . 0.0 111.346 -179.54 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 11' ' ' THR . . . . . 0.603 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 9.5 t -167.83 -43.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -179.822 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' B' ' 8' ' ' SER . 28.1 mt -69.9 -41.65 74.41 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.26 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' B' ' 16' ' ' GLU . 2.7 mt-10 -73.97 -41.35 62.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.37 -1.741 . . . . 0.0 108.187 176.582 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . 0.603 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -49.07 -27.31 3.25 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.091 178.519 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . 0.827 HD12 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.57 40.56 0.59 Allowed 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 124.134 0.974 . . . . 0.0 112.385 179.883 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' B' ' 13' ' ' GLU . 7.1 mt-10 -74.59 -66.82 0.69 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.475 179.823 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -107.89 33.39 4.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.231 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 18' ' ' MET . . . . . 0.799 ' HB2' HD12 ' B' ' 15' ' ' LEU . 3.2 mtm -105.36 -84.52 0.5 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 122.322 -0.236 . . . . 0.0 110.684 179.679 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.754 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -48.49 -49.27 36.45 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.26 0.624 . . . . 0.0 111.693 179.873 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -61.33 -65.4 0.7 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.156 0.503 . . . . 0.0 111.26 -179.639 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -32.52 27.79 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.28 179.368 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 22' ' ' GLU . . . . . 0.526 ' HB2' ' O ' ' B' ' 18' ' ' MET . 18.5 mm-40 -91.22 -6.8 52.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.22 4.45 68.54 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.295 -0.955 . . . . 0.0 111.666 -178.03 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 24' ' ' LEU . . . . . 0.754 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.1 mt -78.92 169.48 18.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.501 0.667 . . . . 0.0 111.174 179.911 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 92.5 p -112.24 161.06 17.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.477 178.036 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.38 -37.14 0.96 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.48 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.622 ' HA ' HD12 ' A' ' 5' ' ' ILE . 1.5 m -83.26 -58.12 2.97 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.644 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.403 ' HB3' HD21 ' B' ' 24' ' ' LEU . 3.2 mt-10 -59.09 -13.85 8.2 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.496 178.944 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.827 ' SD ' HD12 ' B' ' 15' ' ' LEU . 3.3 tpt -80.76 -47.17 14.3 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 122.679 1.228 . . . . 0.0 108.494 178.059 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.615 HG22 HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -75.94 -28.97 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.206 0 CA-C-N 112.794 -2.003 . . . . 0.0 113.219 -177.319 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.404 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -68.2 -48.55 64.9 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 122.329 1.062 . . . . 0.0 108.668 177.105 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.97 -48.28 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.577 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.794 -179.533 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . 0.642 ' CB ' HD21 ' A' ' 34' ' ' LEU . . . -47.76 -38.49 15.61 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.49 179.051 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.639 HD21 ' CB ' ' A' ' 33' ' ' ALA . 11.6 mt -74.67 -31.07 61.81 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.957 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -82.69 -13.82 55.7 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.111 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -124.78 21.66 8.3 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.786 0.327 . . . . 0.0 111.4 177.889 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.548 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 0.6 OUTLIER -81.1 131.79 35.32 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.66 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.46 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.121 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 178.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.991 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 120.982 0.42 . . . . 0.0 111.968 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -96.0 118.99 33.7 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 4.5 tp -118.54 134.84 54.78 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.228 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.762 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -124.46 127.57 47.69 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.085 178.535 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.821 ' CD1' HG21 ' B' ' 30' ' ' ILE . 1.1 pt -152.91 -176.51 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.749 ' O ' HD13 ' A' ' 7' ' ' LEU . 71.4 t-105 -97.03 93.15 6.42 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -177.038 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.902 HD11 HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -128.04 109.34 11.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 177.392 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.749 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 9.1 p -79.13 -176.29 5.05 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -43.39 -59.12 2.25 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 113.769 -1.559 . . . . 0.0 112.992 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -47.43 -26.25 1.29 Allowed 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.625 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 21.9 p -101.25 -29.41 12.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 8' ' ' SER . 43.6 mt -73.54 -40.68 63.79 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 178.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.99 -40.71 94.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.551 175.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.625 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -52.8 -48.22 67.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.282 -1.326 . . . . 0.0 109.282 178.131 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.95 HD21 HD13 ' B' ' 34' ' ' LEU . 15.6 mt -71.61 9.92 0.76 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.473 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -102.53 -48.62 4.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.561 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.473 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 30.3 mttm -72.25 -40.8 67.43 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.017 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.708 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 43.4 mtm -68.97 -63.81 0.99 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.714 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.651 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -47.46 -49.48 25.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.745 0.418 . . . . 0.0 111.676 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' GLU . 15.9 mtp85 . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 121.013 0.435 . . . . 0.0 111.627 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 95.5 mt . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 121.632 0.73 . . . . 0.0 111.561 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 m -114.01 166.05 11.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.335 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.9 -40.1 1.3 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.625 ' HA ' HD12 ' B' ' 5' ' ' ILE . 1.5 m -84.13 -54.2 4.99 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 111.532 0.197 . . . . 0.0 111.532 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.54 ' HB3' HD22 ' A' ' 24' ' ' LEU . 2.3 mm-40 -61.69 -10.74 9.31 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 120.722 0.296 . . . . 0.0 111.063 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.889 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.6 tpt -83.59 -47.32 11.41 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.69 1.233 . . . . 0.0 107.719 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.027 HG21 HD11 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -74.5 -31.53 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 CA-C-N 113.114 -1.857 . . . . 0.0 113.397 -178.167 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.431 ' OD1' HG21 ' B' ' 11' ' ' THR . 0.1 OUTLIER -65.54 -46.9 77.78 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.414 1.102 . . . . 0.0 108.555 177.201 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.402 ' N ' HD22 ' A' ' 31' ' ' ASN . 2.2 t -58.97 -47.37 90.03 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.595 0 CA-C-N 112.752 -2.022 . . . . 0.0 111.048 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.686 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -48.8 -37.69 19.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.29 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.1 HD13 HD21 ' B' ' 15' ' ' LEU . 13.4 mt -77.98 -29.74 49.86 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.973 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -79.47 -16.14 56.59 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -125.44 14.98 8.26 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.499 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.4 OUTLIER -71.64 137.7 48.1 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.952 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.182 0 C-N-CA 123.383 0.673 . . . . 0.0 112.259 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.749 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.5 mpt_? . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.808 0.337 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -99.56 119.83 38.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.602 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.9 tp -130.95 135.03 47.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.412 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.762 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -117.88 128.84 55.22 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.547 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.027 HD11 HG21 ' A' ' 30' ' ' ILE . 4.6 pt -147.77 178.65 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.505 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.8 t-105 -99.75 103.14 14.77 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -176.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.77 HD11 HG22 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -126.23 118.97 26.25 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 177.084 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 8' ' ' SER . . . . . 1.013 ' C ' HD23 ' B' ' 12' ' ' LEU . 0.3 OUTLIER -84.06 -161.49 0.55 Allowed 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.857 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 9' ' ' ASP . . . . . 0.673 ' O ' HG22 ' B' ' 11' ' ' THR . 2.6 p-10 -61.53 -168.6 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.359 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 10' ' ' GLN . . . . . 0.517 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.9 tt0 37.65 41.59 0.32 Allowed 'General case' 0 C--N 1.345 0.373 0 C-N-CA 123.456 0.702 . . . . 0.0 112.771 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.673 HG22 ' O ' ' B' ' 9' ' ' ASP . 11.5 t 177.32 -51.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.83 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 1.013 HD23 ' C ' ' B' ' 8' ' ' SER . 0.5 OUTLIER -67.49 -30.46 70.16 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 176.32 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.417 ' HG2' ' HG ' ' B' ' 12' ' ' LEU . 2.1 mm-40 -91.85 -38.64 12.21 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.424 177.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.655 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.1 t70 -44.39 -27.04 0.39 Allowed 'General case' 0 C--N 1.342 0.259 0 CA-C-N 114.438 -1.256 . . . . 0.0 111.045 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.1 HD21 HD13 ' A' ' 34' ' ' LEU . 33.2 mt -70.75 25.2 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 31.9 mt-10 -101.64 -55.75 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -75.18 -23.38 57.69 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.355 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.902 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 19.2 mtm -87.14 -22.28 25.44 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.102 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.761 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.72 -66.42 0.92 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.252 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.9 mtt-85 -58.13 -65.1 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.978 0.418 . . . . 0.0 111.854 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.11 -33.26 18.15 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.275 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.514 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.6 mm-40 -87.39 -9.41 54.84 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.423 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.14 -8.26 77.36 Favored Glycine 0 C--N 1.339 0.696 0 C-N-CA 120.705 -0.759 . . . . 0.0 111.762 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.761 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 78.1 mt -72.14 174.89 6.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.541 0.686 . . . . 0.0 111.495 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.5 p -120.2 166.04 13.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.547 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.558 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -43.97 -39.45 4.07 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.362 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m -83.82 -53.08 5.87 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 121.996 0.119 . . . . 0.0 111.205 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.33 -7.37 6.18 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.716 0.294 . . . . 0.0 110.737 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.902 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.4 tpt -87.09 -48.56 7.98 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 122.632 1.206 . . . . 0.0 107.968 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.902 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -75.81 -36.75 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.08 0 CA-C-N 112.988 -1.915 . . . . 0.0 112.926 -177.81 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.43 -46.17 87.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.313 1.054 . . . . 0.0 108.585 177.129 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.42 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -60.07 -44.68 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 CA-C-N 112.919 -1.946 . . . . 0.0 110.759 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.709 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -51.11 -39.48 56.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.352 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.95 HD13 HD21 ' A' ' 15' ' ' LEU . 12.9 mt -73.28 -30.34 63.35 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.318 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -76.5 -19.47 57.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -129.73 20.44 5.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.686 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -72.8 134.11 44.78 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.727 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 2.3 mmpt? . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.453 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.84 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.783 0.325 . . . . 0.0 111.479 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.53 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 98.1 m95 -70.85 163.96 26.28 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.635 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.9 tp -163.74 142.99 8.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.501 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.794 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -123.79 134.59 53.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.699 178.954 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.765 HD11 HG21 ' B' ' 30' ' ' ILE . 1.8 pt -150.05 179.3 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.45 ' C ' HD22 ' A' ' 7' ' ' LEU . 76.9 t-105 -95.9 92.66 6.62 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.19 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.887 HD11 HG22 ' B' ' 30' ' ' ILE . 1.5 mm? -122.91 114.61 20.68 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.755 ' O ' HD23 ' A' ' 12' ' ' LEU . 27.0 p -72.68 -179.58 3.14 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.421 0.629 . . . . 0.0 110.27 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.489 ' O ' HG22 ' A' ' 11' ' ' THR . 3.8 p-10 -60.55 -160.48 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.379 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.523 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.87 43.27 0.27 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 123.634 0.773 . . . . 0.0 113.006 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.698 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t 177.44 -50.28 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.64 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.89 HD21 ' HD2' ' B' ' 1' ' ' ARG . 0.7 OUTLIER -70.84 -30.79 67.3 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.931 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -89.24 -37.93 14.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.566 -1.652 . . . . 0.0 107.936 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.698 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -50.61 -17.42 0.51 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.335 -1.302 . . . . 0.0 111.156 178.639 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.012 HD21 HD13 ' B' ' 34' ' ' LEU . 49.1 mt -69.04 25.75 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 179.468 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -97.94 -54.27 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.32 -21.47 62.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.282 179.144 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.952 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 8.6 mtm -90.77 -23.05 20.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.709 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.723 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -101.13 -64.77 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.545 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 . . . . . 0 N--CA 1.469 0.5 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.146 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.723 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.9 mt . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 121.582 0.706 . . . . 0.0 111.485 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.5 p -117.57 168.18 10.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.455 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.553 ' NZ ' HD11 ' B' ' 3' ' ' LEU . 4.5 mmmm -46.39 -39.77 10.97 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.437 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.63 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 2.3 m -84.56 -52.34 6.2 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.132 0.173 . . . . 0.0 111.408 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.442 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.3 mm-40 -62.55 -7.28 4.39 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.7 0.286 . . . . 0.0 110.738 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.952 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.8 tpt -87.1 -48.5 8.03 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 122.657 1.218 . . . . 0.0 107.97 177.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.118 HG21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -76.12 -37.94 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.981 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.911 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.51 HD21 HG21 ' B' ' 11' ' ' THR . 0.2 OUTLIER -62.92 -45.22 93.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 122.335 1.064 . . . . 0.0 108.604 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -62.23 -42.9 97.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 112.85 -1.977 . . . . 0.0 111.328 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.723 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.39 -35.39 28.04 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.521 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.027 HD13 HD21 ' B' ' 15' ' ' LEU . 15.3 mt -76.45 -31.11 57.65 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.35 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -77.68 -16.49 58.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -126.57 16.85 7.56 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.512 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.3 OUTLIER -70.51 137.75 50.46 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.128 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.848 -1.072 . . . . 0.0 112.265 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.89 ' HD2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 120.829 0.347 . . . . 0.0 111.487 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.83 156.66 39.05 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.015 0.436 . . . . 0.0 110.065 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.553 HD11 ' NZ ' ' A' ' 26' ' ' LYS . 4.8 tp -159.38 139.23 11.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.157 -178.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.794 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -122.8 133.94 54.43 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.218 179.439 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.118 HD12 HG21 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -154.79 -176.8 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.699 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.768 ' O ' HD13 ' B' ' 7' ' ' LEU . 70.6 t-105 -92.51 88.2 6.26 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 1.033 HD11 HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -127.33 96.62 4.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.84 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 31.0 p -65.94 179.93 0.82 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.882 0.849 . . . . 0.0 112.806 -177.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -50.62 -54.14 25.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.337 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -49.82 -26.14 3.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.583 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 25.3 p -90.97 -28.85 17.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' B' ' 8' ' ' SER . 21.1 mt -76.24 -39.35 54.72 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -60.21 -41.03 92.14 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 113.643 -1.617 . . . . 0.0 107.229 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.606 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -53.94 -40.2 66.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.906 178.231 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.027 HD21 HD13 ' A' ' 34' ' ' LEU . 39.2 mt -77.01 29.41 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.41 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 40.6 mt-10 -99.5 -61.18 1.4 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -74.34 -22.99 58.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.439 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.729 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.9 mtm -85.65 -21.61 28.32 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.845 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.91 -67.5 0.84 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.055 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.41 ' HE ' ' HA ' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -55.81 -63.04 1.3 Allowed 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.969 0.414 . . . . 0.0 111.558 -179.152 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.22 -33.95 9.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.513 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 18' ' ' MET . 13.7 mm-40 -76.22 -28.96 57.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.571 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 102.88 -12.41 56.2 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 121.201 -0.523 . . . . 0.0 113.012 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.845 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -87.86 -174.51 4.76 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -179.341 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.0 p -105.02 167.28 9.81 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.93 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' B' ' 29' ' ' MET . 0.4 OUTLIER -49.8 -37.8 31.7 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.469 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.45 ' O ' HD11 ' A' ' 7' ' ' LEU . 4.3 m -79.03 -55.88 4.8 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.411 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.9 mt-10 -56.36 -20.12 17.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.729 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.6 tpt -70.87 -46.68 62.21 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 122.61 1.195 . . . . 0.0 108.68 177.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.887 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -75.57 -31.55 23.47 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.298 0 CA-C-N 113.047 -1.888 . . . . 0.0 113.254 -177.0 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.533 ' OD1' HG21 ' A' ' 11' ' ' THR . 0.0 OUTLIER -65.78 -46.47 78.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 122.397 1.094 . . . . 0.0 108.339 176.318 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.408 ' N ' HD22 ' B' ' 31' ' ' ASN . 1.6 t -58.36 -44.69 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-N 112.711 -2.04 . . . . 0.0 111.142 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.73 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -51.08 -32.18 21.41 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.63 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.012 HD13 HD21 ' A' ' 15' ' ' LEU . 18.6 mt -79.2 -31.39 43.77 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.857 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -78.8 -16.3 57.32 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.0 m80 -124.99 16.88 8.53 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.487 ' CE1' ' HB2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -69.96 138.93 52.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.119 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.487 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.171 0 CA-C-O 118.83 -0.605 . . . . 0.0 111.902 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -98.57 105.63 17.8 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tp -125.54 139.25 53.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.712 -178.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 6.5 m -96.0 139.51 32.08 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.04 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 1.08 HD13 HG21 ' B' ' 30' ' ' ILE . 1.1 pp -152.12 174.06 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.125 0.488 . . . . 0.0 112.227 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.769 ' O ' HD13 ' A' ' 7' ' ' LEU . 70.8 t-105 -90.34 106.76 18.71 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -176.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.04 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -133.15 115.65 15.31 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.446 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.559 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.6 p -89.37 -173.77 4.13 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.494 0.664 . . . . 0.0 111.875 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -49.65 -58.01 6.1 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.025 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -50.86 -27.28 7.09 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.61 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 28.1 p -91.83 -31.23 15.8 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.205 0.816 . . . . 0.0 113.205 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 8' ' ' SER . 46.1 mt -72.17 -40.55 67.88 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.49 -41.2 98.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.079 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.61 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.16 -44.88 61.55 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.404 178.949 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.101 HD22 ' CG ' ' A' ' 29' ' ' MET . 22.9 mt -79.41 24.87 0.33 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -104.47 -58.81 1.83 Allowed 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -73.86 -32.03 63.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.425 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.561 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 43.1 mtm -74.09 -61.72 1.75 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.224 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.845 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -51.8 -48.38 63.87 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 . . . . . 0 CA--C 1.512 -0.512 0 CA-C-O 121.031 0.443 . . . . 0.0 111.218 -179.534 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.845 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 111.854 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.3 p -104.03 165.68 10.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.723 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.478 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 6.9 mttm -40.74 -41.39 1.53 Allowed 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.582 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 85.3 p -73.43 -59.3 2.78 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.326 0.108 . . . . 0.0 111.022 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.549 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 1.8 mm-40 -57.21 -22.07 38.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.176 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' MET . . . . . 1.101 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -71.67 -48.43 47.61 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.891 1.329 . . . . 0.0 108.751 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.903 HG21 HD13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -76.32 -31.74 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.266 0 CA-C-N 112.713 -2.039 . . . . 0.0 114.185 -176.588 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.443 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -70.17 -47.29 62.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 122.155 0.979 . . . . 0.0 109.797 178.383 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.549 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -65.02 -39.14 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-N 113.309 -1.768 . . . . 0.0 111.122 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.705 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -42.87 -61.56 1.24 Allowed 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.419 -1.264 . . . . 0.0 112.169 -179.281 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.864 ' HB3' ' HB2' ' B' ' 33' ' ' ALA . 0.0 OUTLIER -75.07 -28.69 60.45 Favored 'General case' 0 N--CA 1.432 -1.37 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.636 -177.019 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.858 ' N ' HD22 ' A' ' 34' ' ' LEU . 8.1 mt-30 -58.17 -20.22 39.18 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.333 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -120.41 25.09 10.02 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.2 0.524 . . . . 0.0 109.683 175.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.695 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -91.5 141.21 28.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.153 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.152 0 C-N-CA 123.471 0.708 . . . . 0.0 112.16 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 2.1 mpt_? . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.858 0.361 . . . . 0.0 111.679 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -109.98 109.27 19.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.475 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.4 tp -134.46 144.25 48.0 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.205 -178.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -96.46 137.1 36.04 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.903 HD13 HG21 ' A' ' 30' ' ' ILE . 4.4 pt -137.41 170.84 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.582 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 75.1 t-105 -100.31 106.81 18.47 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -177.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.784 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.7 OUTLIER -126.85 114.64 18.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.921 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.585 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 14.3 p -83.04 178.11 8.29 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.814 0.816 . . . . 0.0 112.13 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -51.7 -50.73 59.89 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.921 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -45.46 -35.68 3.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.474 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.819 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -104.7 -14.22 15.65 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' B' ' 8' ' ' SER . 94.1 mt -65.07 -39.25 92.97 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.13 -43.93 93.76 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 113.496 -1.684 . . . . 0.0 107.98 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.819 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -52.67 -40.29 62.74 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.545 178.839 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.743 HD22 ' CG ' ' B' ' 29' ' ' MET . 14.6 mt -77.95 28.96 0.17 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -104.16 -61.54 1.43 Allowed 'General case' 0 N--CA 1.461 0.11 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.51 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 16.6 mtpp -71.87 -21.74 61.61 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.345 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.795 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 25.7 mtm -90.22 -24.72 20.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.399 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.702 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -104.16 -64.38 1.11 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.515 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 10.7 mtp-105 -60.16 -65.74 0.63 Allowed 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 120.998 0.428 . . . . 0.0 111.69 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ARG . . . . . 0.51 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -50.6 -33.43 22.06 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.421 179.826 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' B' ' 18' ' ' MET . 16.1 mm-40 -84.84 -11.18 56.22 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.174 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.08 -5.67 84.74 Favored Glycine 0 C--N 1.339 0.737 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.856 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.886 HD22 ' HB3' ' B' ' 28' ' ' GLU . 72.4 mt -75.49 175.58 8.36 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.568 0.699 . . . . 0.0 111.295 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 10.6 p -119.76 174.5 6.39 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.652 -1.158 . . . . 0.0 108.8 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.486 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.0 mttm -51.14 -29.54 13.84 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 111.687 0.254 . . . . 0.0 111.687 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.636 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 34.5 m -82.51 -60.58 2.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.529 0.332 . . . . 0.0 111.496 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.886 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.6 mt-10 -61.03 -9.19 4.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.221 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.795 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.9 tpt -86.58 -46.62 9.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 1.08 HG21 HD13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -75.22 -32.89 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 CA-C-N 113.042 -1.89 . . . . 0.0 113.282 -178.186 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.487 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -70.78 -50.37 36.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 122.119 0.961 . . . . 0.0 109.203 177.776 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.487 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -54.79 -40.31 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 CA-C-N 113.212 -1.813 . . . . 0.0 109.844 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.864 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . . . -44.44 -43.69 7.94 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.894 -1.503 . . . . 0.0 111.242 178.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.908 HD13 HD21 ' A' ' 15' ' ' LEU . 9.4 mt -78.54 -29.25 46.29 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.148 -177.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -70.66 -25.43 63.0 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -133.4 21.65 4.0 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.575 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -64.58 140.21 58.84 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 177.778 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.479 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.661 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.997 ' HD3' HD21 ' B' ' 12' ' ' LEU . 1.5 ttt-85 . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.35 118.57 25.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.545 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 mm? -131.46 148.92 52.69 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.436 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.869 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -117.04 128.6 55.32 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.436 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.673 ' CD1' HG21 ' B' ' 30' ' ' ILE . 2.4 pp -154.92 172.41 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.774 0.321 . . . . 0.0 111.387 -178.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.613 ' O ' ' HB2' ' B' ' 27' ' ' SER . 57.9 t-105 -79.56 78.21 6.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.553 0.692 . . . . 0.0 111.088 -179.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.026 HD11 HG21 ' A' ' 11' ' ' THR . 54.2 tp -115.54 76.14 0.99 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.755 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 24.3 p -76.1 -145.04 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.475 -177.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.13 -155.28 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.245 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.53 44.43 0.11 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.323 0.649 . . . . 0.0 112.299 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . 1.026 HG21 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -178.5 -50.34 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.432 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.563 HD21 HD22 ' B' ' 3' ' ' LEU . 19.1 mt -70.17 -41.09 74.23 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 175.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -79.09 -39.78 32.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.037 -1.892 . . . . 0.0 108.323 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.759 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -50.6 -29.08 10.01 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.796 178.623 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.281 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -77.38 31.8 0.15 Allowed 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.217 1.007 . . . . 0.0 112.929 179.71 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -76.61 -59.81 2.61 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -96.71 13.13 29.45 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.706 ' HB2' HD13 ' A' ' 15' ' ' LEU . 8.5 mtm -102.08 -76.68 0.57 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.09 0.405 . . . . 0.0 111.271 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.904 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -26.39 -32.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 126.507 1.923 . . . . 0.0 114.377 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 31.4 mmm-85 . . . . . 0 C--N 1.307 -1.25 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.344 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.478 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 122.151 0.977 . . . . 0.0 112.953 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -65.09 167.57 7.82 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.171 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -43.05 64.19 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' B' ' 6' ' ' TRP . 23.7 p -83.81 -47.52 11.03 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.892 -0.14 . . . . 0.0 111.086 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -56.04 -30.5 62.0 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' MET . . . . . 1.281 ' SD ' HD11 ' A' ' 15' ' ' LEU . 4.7 tpt -59.83 -47.83 84.12 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 122.69 1.233 . . . . 0.0 109.952 177.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.105 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -79.34 -27.09 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.508 0 CA-C-N 112.828 -1.987 . . . . 0.0 114.099 -175.471 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 1.001 HD21 HG21 ' B' ' 11' ' ' THR . 0.2 OUTLIER -70.62 -48.68 53.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 122.286 1.041 . . . . 0.0 108.82 176.664 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.7 t -60.17 -46.19 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-N 112.986 -1.916 . . . . 0.0 111.553 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.877 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -45.54 -40.6 8.84 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.236 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.97 HD21 ' HB2' ' B' ' 33' ' ' ALA . 11.4 mt -80.5 -28.8 37.39 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.245 -177.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -71.91 -13.94 61.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.509 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.6 m80 -129.83 46.25 2.68 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.572 0.225 . . . . 0.0 111.153 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.742 ' HA ' ' CD2' ' B' ' 36' ' ' HIS . 0.8 OUTLIER -60.46 132.12 52.89 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.312 0.577 . . . . 0.0 112.025 179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.633 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.9 mmmt . . . . . 0 C--O 1.249 1.066 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.889 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.755 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 121.028 0.442 . . . . 0.0 111.806 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.4 173.6 4.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.191 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.948 ' CD2' HD23 ' A' ' 7' ' ' LEU . 2.1 tp -173.4 150.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.738 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.869 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.9 OUTLIER -129.47 130.66 46.15 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.463 178.689 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.872 ' CD1' HG21 ' A' ' 30' ' ' ILE . 5.4 pt -144.47 176.66 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.499 ' C ' HD22 ' B' ' 7' ' ' LEU . 76.4 t-105 -103.05 98.4 8.35 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 1.105 HD11 HG22 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -125.55 126.98 45.68 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 175.742 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.509 ' O ' HD23 ' B' ' 12' ' ' LEU . 2.3 t -81.87 -150.46 0.08 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.141 -0.624 . . . . 0.0 109.496 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' ASP . . . . . 0.432 ' O ' HG22 ' B' ' 11' ' ' THR . 0.7 OUTLIER -87.56 -163.56 0.96 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.783 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 10' ' ' GLN . . . . . 0.443 ' O ' ' HB ' ' B' ' 11' ' ' THR . 2.2 tt0 35.77 39.14 0.06 Allowed 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.448 0.699 . . . . 0.0 112.309 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' THR . . . . . 1.001 HG21 HD21 ' A' ' 31' ' ' ASN . 1.9 t -176.57 -52.36 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.671 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.997 HD21 ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -67.93 -33.15 74.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.266 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.579 ' N ' HD12 ' B' ' 12' ' ' LEU . 29.6 mt-10 -96.41 -37.64 10.37 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.062 -1.426 . . . . 0.0 109.271 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.682 ' HB2' ' N ' ' B' ' 11' ' ' THR . 1.5 m-20 -56.7 -34.54 67.53 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.666 -178.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.925 HD12 ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.58 -5.02 30.28 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.881 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.504 ' N ' HD22 ' B' ' 15' ' ' LEU . 10.9 mm-40 -60.11 -46.95 87.91 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.334 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -55.56 -35.59 65.9 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.101 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.518 ' CE ' ' HB2' ' B' ' 15' ' ' LEU . 34.8 mtm -69.57 -59.8 2.73 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.105 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.763 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -36.41 -46.88 0.58 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.485 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 1.5 mmm-85 -67.7 -73.73 0.13 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -50.86 -29.99 13.32 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.59 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.478 ' HG3' ' HB3' ' B' ' 18' ' ' MET . 25.0 mm-40 -79.29 -27.65 42.24 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.688 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' GLY . . . . . 0.475 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 94.58 67.17 1.02 Allowed Glycine 0 C--N 1.341 0.83 0 C-N-CA 120.263 -0.97 . . . . 0.0 113.587 178.553 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.763 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 177.86 -176.74 0.19 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.099 0.476 . . . . 0.0 111.554 178.038 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 25' ' ' SER . . . . . 0.472 ' N ' HD23 ' B' ' 24' ' ' LEU . 3.5 t -115.79 176.4 5.1 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.125 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.467 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.9 mttm -41.44 -39.53 1.53 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.613 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 26.6 p -73.3 -63.77 1.12 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.674 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.8 mm-40 -59.19 -18.6 37.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.799 ' HG2' ' CD2' ' B' ' 15' ' ' LEU . 1.1 tpt -74.55 -48.08 28.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 123.793 1.758 . . . . 0.0 107.494 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.916 HG22 HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.79 -23.26 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.82 0 CA-C-N 112.79 -2.005 . . . . 0.0 112.062 -178.907 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -85.17 -44.74 12.68 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.741 176.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.771 ' CG2' ' HE3' ' B' ' 29' ' ' MET . 4.4 m -52.39 -34.59 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-O 121.969 0.89 . . . . 0.0 109.211 178.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.97 ' HB2' HD21 ' A' ' 34' ' ' LEU . . . -37.72 -45.33 0.79 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.065 -1.879 . . . . 0.0 111.734 178.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.87 HD13 ' CD2' ' A' ' 15' ' ' LEU . 8.5 mt -83.01 -32.29 27.0 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.638 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -73.89 -21.18 60.18 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.922 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 8.0 p-80 -105.71 -27.84 11.07 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.653 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 12.5 t80 -52.06 149.21 5.33 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.003 0.365 . . . . 0.0 110.067 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.577 ' HD3' ' CE2' ' B' ' 37' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 123.342 0.657 . . . . 0.0 112.455 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.748 ' HD2' ' CD2' ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.727 0.299 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -70.91 128.5 36.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 110.301 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 5' ' ' ILE . 2.3 tp -123.93 135.75 53.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.609 -178.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.768 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -131.84 123.55 27.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.156 179.33 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.869 HD11 HD21 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -152.64 -173.79 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.096 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.617 ' C ' HD22 ' A' ' 7' ' ' LEU . 68.8 t-105 -91.82 92.21 8.28 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -177.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.019 HD11 HG22 ' B' ' 30' ' ' ILE . 2.0 mm? -129.56 103.37 6.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.642 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 28.4 p -66.3 -142.71 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 120.87 0.367 . . . . 0.0 111.515 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -97.46 -147.4 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.065 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.504 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.8 tt0 32.42 45.75 0.06 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.483 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.821 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.6 OUTLIER -172.53 -51.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.694 179.166 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.543 HD13 HD13 ' B' ' 3' ' ' LEU . 17.1 mt -72.19 -41.47 66.92 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -81.15 -38.79 26.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.59 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.821 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -42.83 -28.52 0.25 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-N 114.538 -1.21 . . . . 0.0 111.081 179.209 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.847 ' CD2' HD23 ' B' ' 34' ' ' LEU . 0.1 OUTLIER -65.24 9.0 0.12 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -53.56 -41.03 66.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -87.26 -24.63 24.3 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.264 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.75 ' HB2' HD12 ' A' ' 15' ' ' LEU . 4.1 mtm -97.75 -65.85 0.94 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.741 ' H ' HD12 ' A' ' 15' ' ' LEU . . . -33.9 -31.38 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 . . . . . 0 C--N 1.31 -1.136 0 C-N-CA 119.524 -0.87 . . . . 0.0 110.743 179.453 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.686 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 122.11 0.957 . . . . 0.0 113.192 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.461 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.1 p -62.51 159.34 15.91 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.341 -1.3 . . . . 0.0 109.468 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.46 -42.31 6.97 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.7 p -80.88 -40.97 23.87 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.686 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mm-40 -61.82 -28.39 69.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.125 -0.23 . . . . 0.0 110.757 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.841 ' SD ' HD21 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -67.11 -42.38 84.62 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-O 122.512 1.148 . . . . 0.0 108.567 177.586 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.653 HG22 ' CD1' ' B' ' 7' ' ' LEU . 0.3 OUTLIER -76.77 -35.04 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.365 0 CA-C-N 112.725 -2.034 . . . . 0.0 113.473 -175.474 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.443 HD21 HG21 ' B' ' 11' ' ' THR . 0.1 OUTLIER -63.97 -46.85 82.83 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -58.7 -41.27 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 CA-C-N 112.635 -2.075 . . . . 0.0 111.425 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.998 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -45.42 -41.16 8.95 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.696 -1.138 . . . . 0.0 112.119 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.887 HD22 HD21 ' B' ' 15' ' ' LEU . 7.0 mt -81.47 -29.87 33.57 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.961 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -71.67 -17.51 62.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 33.2 m80 -118.23 39.61 3.38 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.609 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 58.1 t80 -90.01 162.81 15.19 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.374 -178.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.557 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.271 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.642 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.978 0.418 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -75.82 138.45 41.16 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.963 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.543 HD13 HD13 ' A' ' 12' ' ' LEU . 2.2 tp -128.33 133.13 48.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.469 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.768 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -126.19 123.78 38.99 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.776 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.86 HG13 HD21 ' B' ' 7' ' ' LEU . 1.6 pt -154.29 175.69 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.441 ' O ' HD13 ' B' ' 7' ' ' LEU . 75.3 t-105 -88.57 96.13 10.51 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.86 HD21 HG13 ' B' ' 5' ' ' ILE . 1.1 mm? -119.5 118.93 32.39 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.734 ' O ' HD23 ' B' ' 12' ' ' LEU . 44.9 p -65.7 164.97 13.41 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.995 0.903 . . . . 0.0 111.165 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' ASP . . . . . 0.441 ' HA ' ' CD2' ' B' ' 12' ' ' LEU . 8.3 t70 -64.45 -37.9 89.16 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 113.633 -1.621 . . . . 0.0 112.924 -177.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -73.16 38.75 0.09 Allowed 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.806 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 7.9 t -174.17 -51.54 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.975 0.51 . . . . 0.0 111.877 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.748 ' CD2' ' HD2' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -57.54 -28.61 63.68 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 176.674 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 68.7 mm-40 -84.23 -38.9 19.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.393 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.806 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.2 t70 -44.14 -29.58 0.64 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.829 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.887 HD21 HD22 ' A' ' 34' ' ' LEU . 28.9 mt -79.4 27.07 0.27 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.425 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.1 OUTLIER -111.46 -52.18 2.8 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.247 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -76.93 -32.68 57.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 120.835 0.35 . . . . 0.0 110.597 178.812 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.467 ' HE3' ' CG ' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -97.25 20.64 11.14 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.111 179.32 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.91 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -100.03 -19.79 16.36 Favored 'General case' 0 C--O 1.214 -0.779 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.431 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 39.1 mmm-85 -65.67 -126.35 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.726 0 O-C-N 121.657 -0.652 . . . . 0.0 110.468 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -52.69 -22.85 5.64 Favored 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 121.681 -0.637 . . . . 0.0 110.439 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -93.64 -23.43 18.27 Favored 'General case' 0 CA--C 1.522 -0.127 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' GLY . . . . . 0.91 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -134.99 16.28 4.22 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 117.19 -2.433 . . . . 0.0 116.369 -177.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.733 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.0 OUTLIER 55.56 -166.18 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.653 1.226 . . . . 0.0 113.667 175.846 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.1 m -53.94 149.56 8.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.145 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -41.8 -46.44 3.9 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.621 ' O ' HD11 ' A' ' 7' ' ' LEU . 74.5 p -75.87 -44.13 42.19 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.652 0.263 . . . . 0.0 110.702 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.653 ' O ' HG22 ' B' ' 32' ' ' VAL . 3.6 mt-10 -54.78 -38.68 67.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.74 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.865 ' HE3' HG23 ' B' ' 32' ' ' VAL . 4.0 tpt -57.89 -47.21 83.45 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 123.623 1.678 . . . . 0.0 108.935 177.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 1.019 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -65.9 -21.45 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.667 0 CA-C-N 112.972 -1.922 . . . . 0.0 112.649 -178.099 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.582 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -83.53 -46.36 12.52 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 177.49 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.865 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -58.66 -30.3 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.062 0 CA-C-O 121.878 0.847 . . . . 0.0 109.009 177.833 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 1.001 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.15 -54.71 1.73 Allowed 'General case' 0 CA--C 1.495 -1.14 0 CA-C-N 113.599 -1.637 . . . . 0.0 108.729 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.103 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -67.44 -46.72 72.26 Favored 'General case' 0 N--CA 1.399 -2.976 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.243 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 35' ' ' GLN . . . . . 1.103 ' N ' HD13 ' B' ' 34' ' ' LEU . 27.0 mt-30 -64.21 -59.33 4.55 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 1.001 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.3 p80 -65.87 -16.41 63.81 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.728 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.8 OUTLIER -55.83 137.69 49.62 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.577 0.351 . . . . 0.0 110.298 178.682 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.474 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.067 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.82 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.775 0.322 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.482 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.5 m95 -78.95 165.76 23.12 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.427 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 tp -171.34 147.29 2.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.238 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.932 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -108.57 140.32 42.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.824 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.947 ' CD1' HG21 ' B' ' 30' ' ' ILE . 3.8 pt -147.92 176.64 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.715 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 76.6 t-105 -100.86 100.77 11.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.815 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.7 OUTLIER -131.18 114.62 15.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.77 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -88.54 -167.11 1.78 Allowed 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.422 0.63 . . . . 0.0 112.303 -178.209 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -50.85 -57.99 7.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.784 -1.098 . . . . 0.0 112.419 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.25 -29.55 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.623 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 69.8 p -95.26 -33.39 12.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 8' ' ' SER . 69.9 mt -67.94 -40.69 83.23 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 178.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -59.98 -43.91 94.81 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.749 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.623 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -57.06 -51.62 68.53 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.395 -1.275 . . . . 0.0 109.564 178.236 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.982 HD22 ' CG ' ' A' ' 29' ' ' MET . 14.8 mt -78.15 24.56 0.25 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.87 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.448 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -114.99 -52.96 2.67 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 178.454 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HG2' ' HG2' ' A' ' 16' ' ' GLU . 0.8 OUTLIER -87.49 -32.82 19.25 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 122.667 0.387 . . . . 0.0 110.782 178.522 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.752 ' HE1' ' HB2' ' B' ' 34' ' ' LEU . 0.5 OUTLIER -91.73 6.04 47.49 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.46 179.619 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -97.21 -15.53 20.81 Favored 'General case' 0 C--O 1.211 -0.928 0 C-N-CA 122.669 0.388 . . . . 0.0 111.737 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.429 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.785 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.73 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 122.341 1.067 . . . . 0.0 113.54 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.488 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.8 p -60.48 156.78 15.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.666 178.147 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.55 -40.15 2.56 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.447 ' OG ' HG22 ' B' ' 5' ' ' ILE . 29.3 m -79.68 -49.36 12.21 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.247 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.73 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.2 mm-40 -55.49 -30.41 60.57 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.387 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.982 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -61.01 -50.84 71.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.069 1.414 . . . . 0.0 108.767 177.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.011 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -71.81 -34.66 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.523 0 CA-C-N 112.929 -1.941 . . . . 0.0 114.133 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.25 -47.98 72.0 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.872 0.844 . . . . 0.0 109.092 177.284 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.534 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.12 -39.43 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-N 113.684 -1.598 . . . . 0.0 111.445 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.577 ' O ' ' HB1' ' B' ' 33' ' ' ALA . . . -47.56 -40.37 18.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.063 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.004 HD13 ' CD2' ' B' ' 15' ' ' LEU . 11.9 mt -78.51 -28.47 46.25 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.364 -177.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -77.23 -18.83 57.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.6 m80 -104.75 -38.79 6.56 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.539 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 24.6 t80 -44.32 153.6 0.15 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.954 0.407 . . . . 0.0 111.966 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.522 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 9.3 mmmt . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.493 -0.765 . . . . 0.0 111.364 177.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.77 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.2 mpt_? . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.194 0.521 . . . . 0.0 111.861 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 74.4 m95 -114.66 105.04 12.59 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.468 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 1.5 tp -126.49 146.57 50.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.819 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.932 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -106.01 136.73 45.15 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.921 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.011 HD12 HG21 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -148.41 -177.57 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.403 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.666 ' O ' HD13 ' B' ' 7' ' ' LEU . 65.7 t-105 -92.28 90.13 7.14 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.907 HD11 HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -127.01 94.41 4.02 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.82 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 42.6 p -64.58 177.54 0.89 Allowed 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.79 0.805 . . . . 0.0 112.342 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -52.87 -50.07 64.54 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.196 -1.365 . . . . 0.0 111.67 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.0 -26.55 6.18 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.642 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 26.1 p -92.45 -25.65 18.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.455 HD11 ' HE ' ' A' ' 1' ' ' ARG . 22.7 mt -77.88 -40.71 39.12 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.72 -40.95 89.7 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 113.957 -1.474 . . . . 0.0 107.233 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.548 ' O ' ' HG3' ' B' ' 18' ' ' MET . 41.8 t0 -54.82 -39.22 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 114.016 -1.447 . . . . 0.0 110.276 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.004 ' CD2' HD13 ' A' ' 34' ' ' LEU . 32.1 mt -76.96 27.72 0.14 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.486 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 47.4 mt-10 -99.82 -54.46 2.9 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -77.48 -22.0 51.97 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.51 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.895 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 11.3 mtm -91.29 -24.21 19.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.944 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.713 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.32 -66.51 0.91 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.486 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -54.7 -67.82 0.24 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -179.419 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -31.44 11.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.405 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.504 ' HB2' ' O ' ' B' ' 18' ' ' MET . 15.9 mm-40 -87.95 -9.94 52.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.261 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.26 -3.39 86.25 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.855 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.713 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 87.3 mt -75.74 172.65 12.28 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.532 0.682 . . . . 0.0 111.6 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.4 p -115.47 163.4 15.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 mttm -42.16 -41.56 2.71 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.715 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 4.3 m -84.77 -50.5 7.53 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.626 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.5 mt-10 -64.49 -7.98 12.07 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.732 0.301 . . . . 0.0 110.245 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.947 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.0 tpt -85.37 -47.15 10.27 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 122.639 1.209 . . . . 0.0 108.028 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.947 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.4 OUTLIER -75.86 -40.96 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 112.971 -1.922 . . . . 0.0 113.141 -177.436 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -44.76 95.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.972 0.891 . . . . 0.0 109.658 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.626 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -70.49 -32.86 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 113.714 -1.585 . . . . 0.0 112.545 -179.208 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.729 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -54.7 -53.14 58.87 Favored 'General case' 0 CA--C 1.501 -0.916 0 CA-C-O 121.889 0.852 . . . . 0.0 110.163 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.934 HD22 HD21 ' A' ' 15' ' ' LEU . 4.0 pp -72.27 -25.52 61.63 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.744 -1.571 . . . . 0.0 112.033 -178.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' GLN . . . . . 0.713 ' N ' HD12 ' B' ' 34' ' ' LEU . 0.9 OUTLIER -66.94 -19.75 65.78 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.389 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 55.0 m80 -116.27 24.37 11.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 175.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -95.87 143.96 26.63 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.323 0.649 . . . . 0.0 110.124 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.499 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.724 -0.655 . . . . 0.0 112.225 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.776 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.071 0.462 . . . . 0.0 111.881 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -112.3 111.04 21.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.263 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -127.3 144.08 51.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.362 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.825 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -109.9 136.65 48.86 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.434 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.797 ' CD1' HD21 ' A' ' 7' ' ' LEU . 1.8 pt -150.08 176.82 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.465 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.3 t-105 -93.61 90.91 6.82 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -177.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.797 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.8 OUTLIER -124.64 104.14 8.52 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.558 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 6.9 t -78.77 -139.1 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -80.59 -160.09 0.28 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.258 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.41 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.9 tt0 35.07 45.07 0.16 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-O 121.538 0.685 . . . . 0.0 111.667 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.782 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.65 -52.33 0.02 OUTLIER 'General case' 0 C--O 1.23 0.079 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.893 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.576 HD11 ' O ' ' A' ' 7' ' ' LEU . 18.1 mt -73.93 -42.09 61.11 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.303 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -76.44 -39.37 53.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 113.125 -1.852 . . . . 0.0 108.207 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.782 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -45.16 -38.69 5.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.302 178.896 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.907 HD12 ' HB2' ' A' ' 19' ' ' ALA . 3.0 mm? -68.68 7.01 0.72 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -62.42 -39.81 94.51 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -102.09 -10.85 19.32 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.727 ' HB2' HD13 ' A' ' 15' ' ' LEU . 29.4 mtm -97.91 -66.11 0.92 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.907 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -36.87 -29.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 20.8 mmm-85 . . . . . 0 C--N 1.312 -1.058 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.437 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.506 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 122.029 0.919 . . . . 0.0 112.739 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -61.14 160.27 10.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.269 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.22 -39.29 13.79 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.679 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 69.5 m -79.04 -44.55 21.96 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.72 0.266 . . . . 0.0 111.72 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 9.8 mm-40 -61.72 -31.31 71.47 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.907 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.723 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.26 -38.8 92.34 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.771 1.272 . . . . 0.0 107.77 177.029 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.088 HG21 HD12 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -76.18 -17.98 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.97 0 CA-C-N 112.744 -2.025 . . . . 0.0 113.569 -176.915 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.532 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -73.18 -51.97 15.86 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.115 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.532 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 7.3 p -65.95 -28.46 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.441 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.798 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -41.97 -42.44 2.81 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.811 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.855 HD21 HD13 ' B' ' 30' ' ' ILE . 9.0 mt -84.49 -27.7 27.25 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.157 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.428 ' HB2' ' HA ' ' A' ' 32' ' ' VAL . 31.2 mt-30 -63.53 -32.58 74.08 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.798 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 14.0 p-80 -97.91 -38.11 9.54 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.339 0.518 . . . . 0.0 112.178 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.563 ' CG ' ' HA ' ' B' ' 33' ' ' ALA . 21.4 t80 -45.87 141.18 3.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.129 0 C-N-CA 123.678 0.791 . . . . 0.0 112.269 178.261 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.558 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 120.725 0.298 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -100.28 114.16 27.42 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 tp -133.07 145.4 50.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.643 -178.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.825 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -111.6 136.34 50.94 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.992 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.088 HD12 HG21 ' A' ' 30' ' ' ILE . 1.5 pt -147.04 -176.89 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.718 ' O ' HD13 ' B' ' 7' ' ' LEU . 71.0 t-105 -98.69 98.49 9.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.984 HD11 HG23 ' A' ' 30' ' ' ILE . 0.8 OUTLIER -131.14 108.8 9.99 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.575 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.776 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -92.52 -164.96 1.25 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.436 0.636 . . . . 0.0 112.053 -178.225 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -45.15 -62.57 1.2 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.513 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -50.79 -29.75 12.39 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.567 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 68.6 p -88.46 -34.74 17.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' B' ' 8' ' ' SER . 45.0 mt -69.95 -40.01 75.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -61.95 -41.92 98.53 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.783 -1.553 . . . . 0.0 107.736 175.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.567 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.4 OUTLIER -53.35 -49.43 67.15 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.003 178.516 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.891 HD22 ' CG ' ' B' ' 29' ' ' MET . 17.9 mt -73.76 8.38 1.97 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.74 -40.1 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.72 -26.59 29.62 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.822 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.0 mtm -86.23 -64.43 1.15 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.752 -0.204 . . . . 0.0 111.4 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.582 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -47.89 -43.94 29.12 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.683 0.393 . . . . 0.0 111.871 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.449 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 24.0 mmm-85 -61.01 -68.76 0.28 Allowed 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 111.597 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -31.64 37.25 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.95 179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.484 ' HB3' ' HG ' ' B' ' 24' ' ' LEU . 20.7 mm-40 -86.51 -10.47 54.04 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.289 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.15 14.22 68.21 Favored Glycine 0 C--N 1.341 0.809 0 C-N-CA 120.499 -0.858 . . . . 0.0 111.582 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.582 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 90.5 mt -86.8 166.77 14.97 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.56 0.695 . . . . 0.0 111.844 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 83.7 p -103.44 164.34 11.71 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.355 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -43.54 -35.98 1.89 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -179.351 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.59 -56.63 3.41 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.254 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.555 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.1 mt-10 -58.89 -15.34 12.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.612 0.244 . . . . 0.0 110.386 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.891 ' CG ' HD22 ' B' ' 15' ' ' LEU . 1.7 tpt -79.29 -48.1 14.72 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 122.6 1.19 . . . . 0.0 108.227 177.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.855 HD13 HD21 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.58 -33.89 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.037 0 CA-C-N 113.191 -1.822 . . . . 0.0 113.436 -177.36 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.405 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -67.65 -45.93 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.798 0.809 . . . . 0.0 109.933 178.291 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.0 OUTLIER -66.77 -37.43 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 114.277 -1.329 . . . . 0.0 112.192 -178.916 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.563 ' HA ' ' CG ' ' A' ' 37' ' ' TYR . . . -61.26 -47.54 85.55 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 122.031 0.92 . . . . 0.0 109.662 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.048 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -68.98 -42.8 76.07 Favored 'General case' 0 N--CA 1.401 -2.881 0 CA-C-N 113.34 -1.755 . . . . 0.0 111.121 -177.908 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 35' ' ' GLN . . . . . 1.048 ' N ' HD13 ' B' ' 34' ' ' LEU . 24.2 mt-30 -64.3 -19.32 65.34 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -94.29 27.29 2.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.179 0.514 . . . . 0.0 109.647 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.688 ' CD1' ' CE1' ' A' ' 36' ' ' HIS . 7.9 t80 -103.16 156.02 18.0 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.494 -178.386 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.419 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.06 0 C-N-CA 124.449 1.1 . . . . 0.0 112.334 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.618 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 3.6 ttt85 . . . . . 0 N--CA 1.486 1.353 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -78.26 124.79 28.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.436 HD22 HD22 ' B' ' 12' ' ' LEU . 2.0 tp -138.61 141.03 39.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.308 -178.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.655 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -106.3 136.53 45.86 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 178.286 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.889 HD12 HG21 ' B' ' 30' ' ' ILE . 4.9 pt -146.95 175.5 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.597 ' C ' HD22 ' A' ' 7' ' ' LEU . 75.0 t-105 -98.78 109.17 21.97 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -177.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.869 HD11 ' CG2' ' B' ' 30' ' ' ILE . 0.9 OUTLIER -131.26 117.18 18.63 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.939 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.556 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 14.9 p -82.86 178.02 8.37 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 121.783 0.802 . . . . 0.0 111.969 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -53.88 -50.43 66.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.962 -1.472 . . . . 0.0 111.788 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.3 -35.9 3.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.229 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.847 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -101.01 -15.97 17.29 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 8' ' ' SER . 78.8 mt -69.58 -38.96 77.57 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 105.474 -2.047 . . . . 0.0 105.474 175.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -61.16 -41.09 96.14 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 113.226 -1.806 . . . . 0.0 107.502 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.847 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -53.58 -48.42 69.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.028 178.075 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.044 HD21 HD13 ' B' ' 34' ' ' LEU . 19.2 mt -80.41 16.07 1.43 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.478 -0.783 . . . . 0.0 113.099 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.563 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -100.41 -44.69 5.82 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.632 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.563 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 7.2 mttm -88.75 -38.74 14.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.703 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.549 ' CE ' HD23 ' A' ' 15' ' ' LEU . 46.8 mtm -66.28 -70.6 0.23 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.497 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.484 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -27.7 -32.1 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 125.081 1.352 . . . . 0.0 114.161 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.469 ' N ' ' O ' ' A' ' 18' ' ' MET . 1.5 mtt-85 . . . . . 0 C--N 1.309 -1.173 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.08 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.603 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 122.15 0.976 . . . . 0.0 113.0 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.463 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 14.8 p -66.22 158.92 27.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.635 -1.166 . . . . 0.0 109.852 178.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.52 -38.73 4.35 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.9 m -79.51 -52.65 7.75 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 122.089 0.156 . . . . 0.0 111.072 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.603 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -57.26 -27.39 62.05 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.26 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.986 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -64.53 -47.83 77.38 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 122.973 1.368 . . . . 0.0 108.824 177.525 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.6 HG22 HD11 ' B' ' 7' ' ' LEU . 0.4 OUTLIER -75.57 -27.83 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.499 0 CA-C-N 112.671 -2.059 . . . . 0.0 114.268 -176.389 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.36 -52.01 15.35 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.812 0.815 . . . . 0.0 109.277 177.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -55.22 -40.18 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-N 113.75 -1.568 . . . . 0.0 111.077 -179.516 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.691 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.34 -40.42 49.11 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.61 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.862 HD22 ' SD ' ' B' ' 29' ' ' MET . 12.1 mt -74.92 -35.49 62.19 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.256 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -74.41 -11.1 60.15 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.5 m80 -106.61 -46.86 3.89 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 117.089 -0.05 . . . . 0.0 110.967 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.696 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 12.0 t80 -41.65 147.68 0.18 Allowed 'General case' 0 CA--C 1.541 0.607 0 O-C-N 123.275 0.359 . . . . 0.0 111.836 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.523 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 6.0 tppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.171 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -95.33 105.81 17.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -121.45 142.87 49.61 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.957 -178.045 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.655 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -108.29 137.47 46.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 177.836 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.861 HD13 HD13 ' B' ' 7' ' ' LEU . 2.4 pp -151.59 167.88 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 121.179 0.514 . . . . 0.0 112.374 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -83.63 94.48 8.11 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.925 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.861 HD13 HD13 ' B' ' 5' ' ' ILE . 0.9 OUTLIER -129.29 99.89 5.39 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.216 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.618 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 52.3 p -72.66 -135.86 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.353 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.19 -151.7 0.27 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.891 -0.141 . . . . 0.0 111.295 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 10' ' ' GLN . . . . . 0.412 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.9 tt0 33.92 43.62 0.07 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.502 0.721 . . . . 0.0 112.634 179.188 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.689 ' CA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -173.24 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.705 179.189 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.734 HD21 ' HB3' ' B' ' 7' ' ' LEU . 22.8 mt -76.55 -42.0 44.57 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.44 -41.21 40.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.483 -1.689 . . . . 0.0 108.293 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.689 ' HB2' ' CA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.28 -17.37 1.74 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.424 179.008 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.051 HD13 ' HB2' ' B' ' 18' ' ' MET . 0.2 OUTLIER -71.59 21.04 0.05 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -179.683 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.17 -56.8 12.2 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 122.251 -0.281 . . . . 0.0 111.155 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 4.6 mtpm? -91.83 -2.05 57.06 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' MET . . . . . 1.051 ' HB2' HD13 ' B' ' 15' ' ' LEU . 3.9 mtm -96.99 -32.79 11.83 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.91 ' HB2' HD12 ' B' ' 15' ' ' LEU . . . -99.33 -73.3 0.63 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.475 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 0.2 OUTLIER -55.97 -62.41 1.72 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.556 0.694 . . . . 0.0 111.47 -179.371 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ARG . . . . . 0.667 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.01 -28.0 3.63 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.708 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.943 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -87.97 -30.72 19.82 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.014 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.97 -7.48 31.22 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.886 -0.673 . . . . 0.0 114.519 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.943 HD13 ' CG ' ' B' ' 22' ' ' GLU . 0.0 OUTLIER -93.9 -174.02 3.31 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.096 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 96.4 p -103.97 164.2 11.86 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.099 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.1 OUTLIER -45.58 -40.47 8.84 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.279 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.596 ' HB2' ' HB3' ' A' ' 6' ' ' TRP . 59.8 p -81.43 -50.5 9.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.421 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.7 mm-40 -59.29 -20.1 51.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.72 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.985 ' SD ' HD21 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -72.22 -39.85 68.23 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 122.629 1.204 . . . . 0.0 108.63 177.469 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.889 HG21 HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -77.88 -38.09 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.482 0 CA-C-N 112.636 -2.074 . . . . 0.0 113.262 -175.494 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.8 -44.56 96.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 122.671 1.224 . . . . 0.0 107.815 175.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.421 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.4 t -59.97 -44.94 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 CA-C-N 112.271 -2.24 . . . . 0.0 111.872 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.696 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -51.8 -33.63 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.294 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.044 HD13 HD21 ' A' ' 15' ' ' LEU . 15.6 mt -76.4 -32.96 58.84 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.442 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -79.41 -16.72 55.71 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -123.73 21.18 9.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.17 0.441 . . . . 0.0 111.324 176.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.57 131.57 37.91 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.793 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.452 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.722 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.816 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.167 0.508 . . . . 0.0 112.104 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -92.02 120.58 32.79 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.56 ' HB3' HD23 ' B' ' 7' ' ' LEU . 2.8 tp -117.45 142.26 47.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.919 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -130.53 125.61 34.72 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.93 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.763 HD11 HG21 ' B' ' 30' ' ' ILE . 2.1 pt -152.02 -178.92 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.476 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.5 t-105 -94.72 98.38 10.74 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -177.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.903 HD11 HG22 ' B' ' 30' ' ' ILE . 1.5 mm? -125.09 111.34 15.23 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.5 t -76.8 -125.07 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 8.9 t70 -95.9 -45.47 6.93 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.412 ' HB3' ' NE2' ' B' ' 35' ' ' GLN . 24.1 mp0 -68.43 45.41 0.04 OUTLIER 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.187 0.595 . . . . 0.0 112.005 -178.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.836 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.5 t -170.62 -42.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 31.4 mt -72.66 -39.82 66.81 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.582 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 0.2 OUTLIER -68.7 -39.58 80.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 113.511 -1.677 . . . . 0.0 107.033 176.01 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.836 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -48.3 -37.93 17.64 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.097 -1.411 . . . . 0.0 109.203 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.036 HD21 HD13 ' B' ' 34' ' ' LEU . 42.4 mt -84.86 33.39 0.53 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.811 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -107.55 -58.03 2.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.03 -33.47 61.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.734 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.644 ' CE ' HD23 ' A' ' 15' ' ' LEU . 33.4 mtm -74.84 -67.42 0.64 Allowed 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.019 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.5 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -28.87 -31.57 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.857 1.263 . . . . 0.0 114.121 -178.699 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' A' ' 18' ' ' MET . 3.7 mtt-85 . . . . . 0 C--N 1.31 -1.151 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.086 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.528 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.163 0 CA-C-O 122.226 1.013 . . . . 0.0 113.38 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -59.89 166.73 2.52 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.97 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -57.63 -42.68 83.87 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.98 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 94.2 p -74.24 -46.11 43.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.711 0.291 . . . . 0.0 110.273 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.528 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.5 mt-10 -61.08 -35.23 76.43 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.777 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.96 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -62.4 -47.95 81.88 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 123.64 1.686 . . . . 0.0 108.687 177.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.039 HG21 HD13 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -67.86 -15.68 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.979 0 CA-C-N 112.876 -1.965 . . . . 0.0 112.876 -177.572 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.3 -46.49 12.56 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.002 176.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.817 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -60.59 -34.86 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.978 0 CA-C-O 121.596 0.712 . . . . 0.0 109.217 177.922 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.961 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.28 -46.76 0.55 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.814 -1.539 . . . . 0.0 111.057 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.031 HD13 HD21 ' B' ' 15' ' ' LEU . 6.3 mt -87.26 -29.72 21.45 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.184 -178.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -83.64 -15.65 48.14 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.961 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -114.64 -4.46 12.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 -179.499 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.698 ' CD2' ' HD3' ' A' ' 38' ' ' LYS . 4.4 t80 -69.03 157.42 36.83 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.698 ' HD3' ' CD2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.181 0 C-N-CA 124.752 1.221 . . . . 0.0 112.899 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.375 0.131 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -81.43 121.52 26.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.68 140.55 50.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.469 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.919 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.84 129.86 56.34 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.466 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.062 HD12 HD21 ' B' ' 7' ' ' LEU . 1.4 pp -156.6 174.41 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.515 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.8 t-105 -91.76 116.11 28.62 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 1.062 HD21 HD12 ' B' ' 5' ' ' ILE . 0.6 OUTLIER -129.03 127.91 42.56 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 177.184 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.922 ' C ' HD23 ' B' ' 12' ' ' LEU . 7.9 p -82.13 -178.33 6.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 121.831 0.825 . . . . 0.0 111.1 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' ASP . . . . . 0.448 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 11.2 t70 -58.36 -44.99 89.06 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.309 -1.314 . . . . 0.0 113.172 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -75.68 40.53 0.19 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.089 0.471 . . . . 0.0 111.939 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.725 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 10.7 t -173.6 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.671 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.922 HD23 ' C ' ' B' ' 8' ' ' SER . 0.4 OUTLIER -61.18 -30.12 70.21 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.048 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.554 ' HG2' ' HG ' ' B' ' 12' ' ' LEU . 2.5 mm-40 -99.52 -36.07 9.67 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.974 -1.466 . . . . 0.0 109.584 177.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.725 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -42.91 -33.41 0.78 Allowed 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.881 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.031 HD21 HD13 ' A' ' 34' ' ' LEU . 49.1 mt -66.74 12.38 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -75.22 -52.47 10.83 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -93.76 -10.15 35.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.692 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.621 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 11.6 mtp -87.11 -21.28 26.11 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.682 0.277 . . . . 0.0 110.966 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.35 -67.93 0.82 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.826 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.8 mmm180 -58.93 -70.28 0.16 Allowed 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.57 -33.6 6.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.796 -179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.621 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 3.8 mm-40 -82.2 -25.41 34.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.291 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 98.6 64.38 0.86 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.439 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.81 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 179.21 178.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.209 0.528 . . . . 0.0 111.634 177.945 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 25' ' ' SER . . . . . 0.551 ' N ' HD23 ' B' ' 24' ' ' LEU . 0.8 OUTLIER -105.2 169.08 8.65 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.71 -178.521 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.89 -41.3 11.17 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.7 p -78.09 -50.65 11.62 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.445 0.164 . . . . 0.0 110.986 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.568 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.1 mm-40 -65.52 -10.6 36.23 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.412 178.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.877 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.9 tpt -84.34 -48.45 9.69 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 122.689 1.233 . . . . 0.0 107.788 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.903 HG22 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -74.13 -34.91 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.95 0 CA-C-N 113.017 -1.901 . . . . 0.0 112.952 -177.985 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.91 -48.24 72.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 122.384 1.088 . . . . 0.0 109.032 177.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.449 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -58.73 -43.79 88.6 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.174 0 CA-C-N 112.865 -1.97 . . . . 0.0 111.671 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.869 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.32 -31.34 3.81 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.005 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.036 HD13 HD21 ' A' ' 15' ' ' LEU . 14.2 mt -91.86 -31.76 15.58 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 35' ' ' GLN . . . . . 0.412 ' NE2' ' HB3' ' A' ' 10' ' ' GLN . 24.7 mt-30 -72.07 -15.03 62.01 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -111.23 19.81 17.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.114 0.415 . . . . 0.0 111.397 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.495 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 58.6 t80 -114.75 165.61 12.63 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.962 0.41 . . . . 0.0 111.823 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.484 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.162 0 C-N-CA 123.869 0.868 . . . . 0.0 112.603 178.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.582 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.696 0.284 . . . . 0.0 111.695 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.41 126.6 31.06 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -125.35 137.7 54.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.684 -178.516 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.955 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -115.98 121.51 42.49 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.231 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.902 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -145.86 176.3 1.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -177.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.628 ' O ' HD13 ' A' ' 7' ' ' LEU . 68.6 t-105 -94.02 100.83 12.89 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -177.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.856 HD21 HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -128.78 111.47 13.15 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 177.318 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.572 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 10.0 p -82.37 -176.79 6.39 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 121.724 0.774 . . . . 0.0 112.487 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -50.56 -47.78 57.72 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.474 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -47.03 -31.2 3.11 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.909 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -109.97 -15.29 14.09 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.5 mt -73.83 -41.04 62.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 105.901 -1.888 . . . . 0.0 105.901 176.227 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.41 -39.12 93.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.333 -1.758 . . . . 0.0 107.996 175.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.909 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -52.08 -44.68 64.47 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.558 178.78 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.041 ' CD2' HD13 ' B' ' 34' ' ' LEU . 19.6 mt -76.82 13.7 0.98 Allowed 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.3 mm-40 -98.9 -51.61 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 19.1 mttp -73.73 -26.1 60.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.211 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.67 ' CE ' HD23 ' A' ' 15' ' ' LEU . 58.8 mtm -81.71 -74.75 0.32 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.933 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.68 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.94 -43.42 3.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 122.908 0.483 . . . . 0.0 112.1 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.1 mmm180 . . . . . 0 CA--C 1.514 -0.414 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.68 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 94.9 mt . . . . . 0 N--CA 1.451 -0.423 0 CA-C-O 121.523 0.678 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.6 p -108.71 164.61 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.973 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.519 ' HB3' HG21 ' B' ' 5' ' ' ILE . 2.4 mttm -46.24 -31.97 2.78 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.418 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.1 m -84.29 -59.23 2.45 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 122.178 0.191 . . . . 0.0 111.139 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.582 ' HB3' HD22 ' A' ' 24' ' ' LEU . 2.8 mm-40 -59.72 -12.64 7.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.159 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' MET . . . . . 1.037 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.0 tpt -82.29 -47.17 12.71 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.855 1.312 . . . . 0.0 107.746 177.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.918 HD11 HD11 ' B' ' 34' ' ' LEU . 0.6 OUTLIER -75.55 -32.01 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 CA-C-N 112.847 -1.978 . . . . 0.0 113.782 -177.818 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.542 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -69.45 -48.81 59.66 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.185 0.993 . . . . 0.0 109.345 178.011 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.424 ' N ' HD22 ' A' ' 31' ' ' ASN . 1.6 t -59.22 -42.93 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.145 -1.843 . . . . 0.0 110.911 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.802 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -44.73 -41.62 6.98 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.331 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.854 HD23 ' CB ' ' B' ' 33' ' ' ALA . 8.2 mt -74.87 -33.98 62.16 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.836 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -70.95 -14.7 62.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.44 30.34 2.64 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.711 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -77.57 133.52 38.46 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 178.664 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.563 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 120.724 0.297 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -91.61 116.38 28.83 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.482 ' HB3' HD23 ' A' ' 7' ' ' LEU . 4.9 tp -116.46 139.43 50.46 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.736 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.955 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -122.95 123.47 40.99 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.239 178.662 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.803 HD12 HD21 ' B' ' 7' ' ' LEU . 1.3 pt -149.33 179.92 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.616 ' O ' HD13 ' B' ' 7' ' ' LEU . 71.1 t-105 -93.15 89.47 6.47 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.803 HD21 HD12 ' B' ' 5' ' ' ILE . 1.3 mm? -128.57 100.22 5.67 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.582 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 53.2 p -57.11 170.94 0.41 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 122.119 0.962 . . . . 0.0 112.779 -177.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.55 -40.0 94.79 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.319 -178.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' GLN . . . . . 0.492 ' O ' ' HB2' ' B' ' 14' ' ' ASP . 3.5 mm-40 -66.53 9.56 0.17 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.679 ' HA ' ' HB3' ' B' ' 14' ' ' ASP . 3.0 t -145.72 19.17 1.48 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' B' ' 8' ' ' SER . 13.0 mt -107.79 -46.4 3.8 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 175.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -88.02 -26.6 22.51 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 114.492 -1.231 . . . . 0.0 108.946 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.679 ' HB3' ' HA ' ' B' ' 11' ' ' THR . 6.5 t70 -55.77 -6.43 0.21 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 113.654 -1.612 . . . . 0.0 113.165 -179.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.955 HD23 ' SD ' ' B' ' 29' ' ' MET . 0.0 OUTLIER -135.86 35.06 2.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 121.357 0.599 . . . . 0.0 111.407 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.462 ' HB2' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -51.22 -31.5 20.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.721 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 9.3 mtpp -62.14 -24.7 67.32 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.078 0.466 . . . . 0.0 110.794 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.78 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 8.6 mtm -86.64 -25.05 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.052 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.611 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -100.3 -73.52 0.63 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.719 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.462 ' HD2' ' HB2' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -56.95 -65.05 0.68 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.163 0.506 . . . . 0.0 112.092 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 13.0 mmp_? -50.54 -27.53 6.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.38 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.862 ' HG2' HD12 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -91.65 -23.69 19.76 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.004 179.524 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.82 -5.55 34.76 Favored Glycine 0 C--N 1.34 0.75 0 C-N-CA 121.342 -0.456 . . . . 0.0 112.405 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.862 HD12 ' HG2' ' B' ' 22' ' ' GLU . 53.5 mt -80.59 178.52 8.29 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.664 0.745 . . . . 0.0 112.017 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 25' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' B' ' 29' ' ' MET . 3.7 t -120.15 179.9 4.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.723 178.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.82 -38.56 61.47 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.026 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.3 m -86.36 -51.31 6.31 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 121.91 0.084 . . . . 0.0 111.087 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.621 ' HB3' HD22 ' B' ' 24' ' ' LEU . 1.6 mm-40 -62.88 -9.3 9.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.413 178.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.955 ' SD ' HD23 ' B' ' 15' ' ' LEU . 4.9 tpt -79.93 -47.79 14.46 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 123.095 1.426 . . . . 0.0 107.685 177.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.902 HG21 HD11 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -79.37 -28.77 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 CA-C-N 112.213 -2.267 . . . . 0.0 114.191 -176.694 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -49.38 51.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.214 1.007 . . . . 0.0 109.087 177.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 2.0 t -56.94 -47.12 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.1 -1.864 . . . . 0.0 110.266 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.854 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -48.84 -37.1 18.47 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.225 178.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.041 HD13 ' CD2' ' A' ' 15' ' ' LEU . 12.9 mt -72.46 -34.87 68.04 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.058 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -79.09 -14.63 59.02 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -130.75 19.87 5.09 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.692 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -73.03 137.02 45.11 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 178.863 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.708 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 1.4 mmpt? . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.718 178.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.432 ' HG2' HD21 ' A' ' 3' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.29 121.53 24.54 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.3 mm? -126.43 141.65 51.81 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.3 OUTLIER -125.55 117.81 24.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.463 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.95 HD11 HG21 ' B' ' 30' ' ' ILE . 4.4 pt -147.33 175.56 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -92.99 98.77 11.57 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 -177.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.927 HD21 HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -119.28 115.38 24.05 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.623 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.0 p -71.58 -134.94 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.425 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.4 t70 -101.21 -41.09 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -73.11 38.97 0.09 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.123 0.487 . . . . 0.0 111.914 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.823 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.7 t -160.59 -43.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.676 HD21 ' HB2' ' A' ' 7' ' ' LEU . 53.8 mt -68.97 -41.04 78.47 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 175.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.65 -39.74 91.7 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 113.425 -1.716 . . . . 0.0 108.065 176.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.823 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t0 -48.0 -36.6 13.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 114.552 -1.203 . . . . 0.0 109.352 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.091 HD21 HD13 ' B' ' 34' ' ' LEU . 43.0 mt -79.85 27.2 0.3 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.099 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -100.86 -59.08 1.76 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -79.61 -5.93 56.04 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.573 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.774 ' CE ' HD23 ' A' ' 15' ' ' LEU . 43.6 mtm -100.99 -66.05 0.93 Allowed 'General case' 0 C--N 1.341 0.228 0 CA-C-N 116.993 -0.094 . . . . 0.0 110.837 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -29.23 -32.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.388 1.075 . . . . 0.0 113.613 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 18' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.311 -1.081 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.733 177.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 122.105 0.955 . . . . 0.0 112.996 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.467 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 1.7 p -61.4 161.09 9.8 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.509 -1.223 . . . . 0.0 109.714 178.126 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.87 -41.59 33.74 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.78 ' HA ' HD12 ' B' ' 5' ' ' ILE . 91.7 p -76.47 -51.72 11.22 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.574 ' O ' HG22 ' A' ' 32' ' ' VAL . 6.3 mt-10 -54.89 -31.22 59.72 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.956 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.5 tpt -64.47 -49.93 69.48 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 123.416 1.579 . . . . 0.0 108.877 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.018 HG21 HD11 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -66.37 -19.39 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.801 0 CA-C-N 113.325 -1.761 . . . . 0.0 112.813 -177.703 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.457 ' OD1' HG21 ' B' ' 11' ' ' THR . 0.0 OUTLIER -79.27 -51.57 9.28 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.634 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.793 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -53.41 -36.17 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.972 0 CA-C-O 121.499 0.666 . . . . 0.0 109.906 178.371 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.839 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.85 -47.68 0.7 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.034 -1.439 . . . . 0.0 111.18 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.045 HD13 ' CD2' ' B' ' 15' ' ' LEU . 5.6 mt -83.92 -25.41 30.18 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.049 -178.404 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -87.92 -9.21 54.33 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.241 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.839 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -136.24 22.22 3.22 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.78 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -88.29 140.45 29.46 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.04 0.536 . . . . 0.0 110.702 179.195 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.569 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.458 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.591 0.234 . . . . 0.0 111.61 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -85.41 123.3 30.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.451 ' HA ' HD13 ' B' ' 3' ' ' LEU . 2.7 mm? -129.12 148.56 51.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.913 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -133.77 121.43 21.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.781 179.176 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.018 HD11 HG21 ' A' ' 30' ' ' ILE . 5.0 pt -148.89 179.71 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.545 ' O ' HD13 ' B' ' 7' ' ' LEU . 75.2 t-105 -97.12 101.99 13.67 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -177.062 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.855 HD21 HG13 ' B' ' 5' ' ' ILE . 0.7 OUTLIER -126.86 117.01 21.74 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 18.4 p -73.18 -149.15 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.015 0.436 . . . . 0.0 111.343 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' ASP . . . . . 0.459 ' O ' HG22 ' B' ' 11' ' ' THR . 16.7 m-20 -96.22 -150.2 0.32 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.238 -178.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 10' ' ' GLN . . . . . 0.412 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 0.9 OUTLIER 35.55 43.15 0.15 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.251 0.62 . . . . 0.0 112.437 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.747 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 4.1 t -172.43 -46.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.403 ' HA ' HD12 ' A' ' 34' ' ' LEU . 19.0 mt -74.19 -39.2 63.33 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -89.63 -36.13 15.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 113.281 -1.781 . . . . 0.0 109.871 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.747 ' HB2' ' N ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -47.67 -25.45 1.2 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.32 -179.089 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.045 ' CD2' HD13 ' A' ' 34' ' ' LEU . 4.2 pp -83.81 34.18 0.49 Allowed 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 30.3 mm-40 -53.76 -28.21 33.33 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 3.3 mmtp -97.53 -5.94 34.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.714 ' HB2' ' HB2' ' B' ' 15' ' ' LEU . 14.2 mtm -89.84 -80.43 0.31 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.838 0.29 . . . . 0.0 110.562 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.69 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -49.03 -44.42 41.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.783 0.433 . . . . 0.0 111.846 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.475 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 2.2 mmm180 -62.74 -68.81 0.3 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 111.807 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 21' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -52.17 -32.6 36.72 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.981 179.488 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.535 ' HB3' ' HG ' ' B' ' 24' ' ' LEU . 21.4 mm-40 -84.9 -11.31 55.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.061 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.64 10.13 75.52 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.281 -177.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.69 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 92.4 mt -83.22 165.08 19.73 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.583 0.706 . . . . 0.0 111.58 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 72.6 p -107.26 164.71 11.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.141 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.13 -37.48 1.44 Allowed 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 3.4 t -82.42 -56.9 3.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.597 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.7 mm-40 -60.19 -14.22 16.35 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.887 0.375 . . . . 0.0 110.761 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.749 ' SD ' HD22 ' B' ' 15' ' ' LEU . 3.1 tpt -79.23 -46.39 17.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.831 1.3 . . . . 0.0 108.24 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.95 HG21 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -78.06 -31.34 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.104 0 CA-C-N 112.656 -2.066 . . . . 0.0 113.594 -177.26 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.496 HD21 HG21 ' A' ' 11' ' ' THR . 0.4 OUTLIER -68.67 -48.38 64.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.24 1.019 . . . . 0.0 109.331 177.768 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 1.4 t -59.75 -43.0 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 CA-C-N 113.071 -1.877 . . . . 0.0 111.154 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.831 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -46.28 -34.43 4.46 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.114 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.091 HD13 HD21 ' A' ' 15' ' ' LEU . 13.5 mt -88.94 -28.48 20.24 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -74.8 -11.01 60.05 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -123.27 27.06 7.69 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.593 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 33.7 t80 -115.99 155.21 28.47 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 111.723 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.431 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.227 178.147 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.625 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.6 mpt_? . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.951 0.405 . . . . 0.0 111.735 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -107.71 109.23 20.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.56 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.441 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 2.2 tp -127.99 147.21 50.49 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.206 -178.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.755 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -108.84 138.21 45.54 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.544 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.844 ' CD1' HG21 ' B' ' 30' ' ' ILE . 2.1 pt -148.5 -179.9 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.546 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.0 t-105 -97.13 93.72 6.72 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -177.42 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.849 HD11 HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -125.78 103.67 7.93 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.896 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.566 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.1 p -74.38 -176.11 2.56 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.781 0.8 . . . . 0.0 112.439 -178.177 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.5 -49.03 65.58 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.689 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -46.05 -34.23 3.96 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.935 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -100.45 -22.38 15.05 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 8' ' ' SER . 59.9 mt -71.55 -39.89 70.36 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 176.644 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.89 -40.61 96.9 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 113.427 -1.715 . . . . 0.0 107.53 175.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.935 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -51.17 -43.29 61.27 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.513 -1.221 . . . . 0.0 108.923 178.138 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.063 HD21 HD13 ' B' ' 34' ' ' LEU . 25.0 mt -86.42 26.43 1.07 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -106.25 -53.42 2.63 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -76.3 -39.62 53.7 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.369 178.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.504 ' HE3' ' SD ' ' A' ' 29' ' ' MET . 35.4 mtm -68.24 -71.77 0.2 Allowed 'General case' 0 C--N 1.341 0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.655 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.496 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -28.08 -32.09 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.165 1.386 . . . . 0.0 114.302 -178.491 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.8 mmm180 . . . . . 0 C--N 1.309 -1.193 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.398 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.268 0 CA-C-O 122.157 0.98 . . . . 0.0 113.052 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.468 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 12.9 p -64.02 159.54 19.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.787 178.217 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.55 -38.84 6.81 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.763 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 22.3 m -81.51 -51.17 8.56 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 111.325 0.121 . . . . 0.0 111.325 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.539 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 4.4 mt-10 -56.56 -27.17 57.16 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' MET . . . . . 1.019 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.8 tpt -63.26 -47.69 81.33 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 122.951 1.357 . . . . 0.0 108.996 177.663 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.012 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -76.95 -36.74 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.599 0 CA-C-N 112.678 -2.055 . . . . 0.0 114.29 -176.456 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.425 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -63.5 -47.06 83.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.015 0.912 . . . . 0.0 108.927 178.04 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.65 -42.78 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.503 0 CA-C-N 113.431 -1.713 . . . . 0.0 110.795 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.76 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -52.59 -38.92 61.0 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.965 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.113 HD13 HD21 ' B' ' 15' ' ' LEU . 13.9 mt -73.98 -29.86 62.19 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.59 -178.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -78.39 -18.6 54.82 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.965 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -107.0 -36.67 6.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.615 ' CE2' ' HB3' ' B' ' 18' ' ' MET . 2.7 t80 -29.06 134.05 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.259 0.623 . . . . 0.0 111.891 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.853 -1.07 . . . . 0.0 112.892 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -82.4 108.99 16.25 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.0 tp -130.26 145.38 51.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.182 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.755 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.0 OUTLIER -103.6 139.61 38.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.552 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.012 HD12 HG21 ' A' ' 30' ' ' ILE . 3.5 pt -148.17 179.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.159 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.763 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.8 t-105 -98.66 100.36 11.58 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -177.153 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.773 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -133.22 114.04 13.36 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 177.378 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.625 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -94.85 -166.35 1.45 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.524 0.678 . . . . 0.0 112.347 -178.244 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -44.93 -63.61 0.88 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.729 -1.123 . . . . 0.0 112.871 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -53.15 -27.23 20.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.664 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 70.0 p -91.08 -34.52 15.05 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.25 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' B' ' 8' ' ' SER . 56.2 mt -67.61 -37.96 83.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -43.35 88.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 113.561 -1.654 . . . . 0.0 107.526 176.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.664 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -52.58 -44.02 65.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.406 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.113 HD21 HD13 ' A' ' 34' ' ' LEU . 16.5 mt -76.29 29.64 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -114.56 -57.5 2.26 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.008 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.42 -31.56 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.636 178.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.796 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 7.9 mtm -82.51 -16.15 49.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.866 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.75 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.73 -65.28 0.97 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.858 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mtp-105 -60.89 -65.91 0.62 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.127 0.489 . . . . 0.0 111.533 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.19 -29.87 6.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.863 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.82 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -85.47 -35.31 21.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.631 179.525 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 23' ' ' GLY . . . . . 0.455 ' N ' ' HG3' ' B' ' 22' ' ' GLU . . . 106.56 67.81 0.67 Allowed Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.919 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.82 HD13 ' CG ' ' B' ' 22' ' ' GLU . 0.0 OUTLIER -178.26 -177.34 0.57 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.272 0.558 . . . . 0.0 112.059 178.299 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 25' ' ' SER . . . . . 0.419 ' N ' HD23 ' B' ' 24' ' ' LEU . 19.1 p -110.81 170.75 7.89 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.121 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.432 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.8 mttm -40.88 -38.73 1.0 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -179.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 1.5 p -79.05 -56.66 4.21 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 117.838 0.29 . . . . 0.0 111.612 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.684 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.1 mt-10 -61.55 -15.63 40.35 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 29' ' ' MET . . . . . 1.045 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.7 tpt -77.15 -48.28 18.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 122.743 1.259 . . . . 0.0 108.279 178.141 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.88 HD11 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.88 -31.75 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.164 0 CA-C-N 112.885 -1.962 . . . . 0.0 113.462 -177.358 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.534 HD21 ' HB ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -68.41 -47.92 66.01 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 122.271 1.034 . . . . 0.0 108.871 177.449 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.421 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.7 t -57.98 -44.69 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.038 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.723 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -49.09 -30.52 6.58 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.033 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.063 HD13 HD21 ' A' ' 15' ' ' LEU . 15.5 mt -80.93 -35.66 32.07 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.996 -177.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -77.86 -11.62 59.91 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -125.19 18.81 8.32 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.651 0.262 . . . . 0.0 111.215 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.42 132.59 38.57 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.767 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.695 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.605 178.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.695 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.493 ' C ' HD22 ' A' ' 3' ' ' LEU . 92.7 m95 -88.4 118.92 28.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.21 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.531 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.3 mm? -136.92 148.64 47.11 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.382 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.851 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -121.09 130.47 53.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 178.799 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.774 HD12 HD21 ' A' ' 7' ' ' LEU . 1.3 pt -147.79 -179.79 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.452 ' C ' HD22 ' A' ' 7' ' ' LEU . 69.3 t-105 -95.2 89.26 5.45 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.774 HD21 HD12 ' A' ' 5' ' ' ILE . 2.1 mm? -120.58 99.36 6.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 p -74.8 -141.04 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.208 -178.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.697 ' O ' HG22 ' A' ' 11' ' ' THR . 2.5 p-10 -79.58 -155.33 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.733 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.439 ' O ' ' HB ' ' A' ' 11' ' ' THR . 2.2 tt0 36.82 43.85 0.31 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.279 0.632 . . . . 0.0 112.412 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.697 HG22 ' O ' ' A' ' 9' ' ' ASP . 11.8 t -174.96 -48.2 0.01 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.096 -0.957 . . . . 0.0 112.152 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.627 HD11 ' O ' ' A' ' 7' ' ' LEU . 15.1 mt -78.23 -39.71 39.55 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 105.68 -1.97 . . . . 0.0 105.68 175.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -41.9 62.94 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 113.268 -1.787 . . . . 0.0 106.933 176.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.69 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.02 -27.3 7.53 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.017 -1.447 . . . . 0.0 109.569 178.231 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.248 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -76.64 31.34 0.13 Allowed 'General case' 0 N--CA 1.426 -1.643 0 C-N-CA 124.161 0.984 . . . . 0.0 113.044 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -74.65 -61.52 1.85 Allowed 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.288 -0.257 . . . . 0.0 111.535 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -98.11 7.2 46.65 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.825 ' HB2' HD13 ' A' ' 15' ' ' LEU . 23.2 mtm -88.18 -82.05 0.24 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.879 0.309 . . . . 0.0 111.617 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.656 ' H ' ' CD1' ' A' ' 15' ' ' LEU . . . -23.87 -35.78 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 126.444 1.898 . . . . 0.0 114.286 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 18' ' ' MET . 5.0 mtt-85 . . . . . 0 C--N 1.306 -1.283 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.087 179.226 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.492 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 121.988 0.899 . . . . 0.0 112.671 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -70.53 150.3 46.26 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.149 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -38.79 -39.43 0.51 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.451 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 m -81.12 -54.96 5.08 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 122.028 0.131 . . . . 0.0 110.734 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -55.32 -29.88 59.15 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' MET . . . . . 1.248 ' SD ' HD11 ' A' ' 15' ' ' LEU . 4.1 tpt -59.45 -47.49 85.3 Favored 'General case' 0 N--CA 1.44 -0.975 0 CA-C-O 123.028 1.394 . . . . 0.0 109.714 177.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.635 HD13 HD21 ' B' ' 34' ' ' LEU . 0.3 OUTLIER -75.77 -21.39 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.686 0 CA-C-N 112.257 -2.247 . . . . 0.0 113.779 -175.812 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.773 HD21 HG21 ' B' ' 11' ' ' THR . 0.6 OUTLIER -78.18 -51.57 10.02 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.983 0.897 . . . . 0.0 109.985 177.164 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.6 t -63.53 -34.98 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-N 113.705 -1.589 . . . . 0.0 111.155 -179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.8 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -46.9 -61.45 1.86 Allowed 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.339 -1.301 . . . . 0.0 112.438 -179.293 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.907 HD22 ' N ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -74.71 -28.09 60.66 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.048 -176.974 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.907 ' N ' HD22 ' A' ' 34' ' ' LEU . 9.2 mt-30 -56.55 -24.4 46.71 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.435 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -125.48 31.53 5.53 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.411 0.624 . . . . 0.0 109.505 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.807 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -87.85 139.38 30.58 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.171 179.896 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.555 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.123 -0.941 . . . . 0.0 111.187 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 2.2 ttt-85 . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -73.97 128.08 34.57 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -133.29 140.47 47.47 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.517 -178.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.851 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -121.55 130.25 53.41 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.619 HD13 HD13 ' B' ' 7' ' ' LEU . 2.3 pp -150.9 165.0 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.342 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -85.48 103.6 14.5 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.761 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.619 HD13 HD13 ' B' ' 5' ' ' ILE . 1.1 tp -124.69 113.87 18.57 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.252 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.904 ' O ' HD23 ' B' ' 12' ' ' LEU . 12.5 p -77.03 -173.44 2.74 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 121.449 0.642 . . . . 0.0 110.74 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -59.41 -155.77 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.562 -1.199 . . . . 0.0 112.528 -178.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' GLN . . . . . 0.517 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.7 tt0 37.45 39.84 0.19 Allowed 'General case' 0 C--N 1.344 0.349 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.773 HG21 HD21 ' A' ' 31' ' ' ASN . 1.2 t 177.61 -51.56 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.965 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.904 HD23 ' O ' ' B' ' 8' ' ' SER . 0.4 OUTLIER -70.64 -27.56 64.14 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.002 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.31 -43.41 6.96 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.415 -1.72 . . . . 0.0 107.66 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.696 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.7 m-20 -56.17 -16.4 5.18 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.201 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.83 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.1 OUTLIER -70.32 23.58 0.03 OUTLIER 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.84 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -87.61 -36.25 17.61 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 11.1 pttm -102.97 -1.92 28.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.819 ' SD ' HD22 ' B' ' 15' ' ' LEU . 53.3 mtp -91.45 -84.49 0.26 Allowed 'General case' 0 C--N 1.34 0.182 0 O-C-N 122.259 -0.276 . . . . 0.0 110.45 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.617 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -45.55 -45.28 13.41 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.343 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -69.18 0.24 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 120.966 0.412 . . . . 0.0 111.769 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -33.49 42.77 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -81.3 -12.18 59.13 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.916 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.29 85.58 Favored Glycine 0 C--N 1.34 0.786 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.569 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.8 HD22 ' HB3' ' B' ' 28' ' ' GLU . 96.5 mt -85.04 174.89 9.38 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.736 0.779 . . . . 0.0 111.392 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 19.4 p -116.58 172.71 7.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.747 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.455 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -48.96 -34.2 12.49 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.477 ' HA ' HD12 ' A' ' 5' ' ' ILE . 4.6 p -86.56 -54.52 4.35 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.446 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.8 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.0 mt-10 -60.02 -11.17 5.21 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.452 0.168 . . . . 0.0 111.038 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.83 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.4 tpt -84.36 -46.98 11.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.532 1.158 . . . . 0.0 107.995 177.335 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.636 HG22 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -76.38 -29.76 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.139 0 CA-C-N 113.038 -1.892 . . . . 0.0 113.132 -177.359 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.473 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -71.49 -50.92 26.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 122.206 1.003 . . . . 0.0 109.088 177.371 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 2.0 t -54.82 -41.58 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 CA-C-N 113.164 -1.835 . . . . 0.0 110.16 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.891 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . . . -43.36 -43.12 4.93 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.831 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.035 HD13 HD23 ' A' ' 15' ' ' LEU . 9.6 mt -79.27 -29.88 42.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.922 -177.286 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -78.56 -16.32 57.57 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -132.55 21.04 4.29 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.463 0.574 . . . . 0.0 112.293 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.543 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -74.79 139.03 43.01 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.178 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.47 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.853 -0.594 . . . . 0.0 112.474 178.418 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.742 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 121.146 0.498 . . . . 0.0 112.034 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -114.12 114.36 25.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.1 tp -129.14 138.42 51.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.429 -177.029 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.891 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -115.97 123.82 48.99 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.859 HG13 HD21 ' A' ' 7' ' ' LEU . 3.9 pt -145.85 178.84 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.521 0.564 . . . . 0.0 112.521 -177.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.559 ' O ' HD13 ' A' ' 7' ' ' LEU . 66.0 t-105 -90.91 98.33 11.71 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.859 HD21 HG13 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -130.24 107.78 9.54 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.686 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 23.0 t -72.45 -129.95 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -178.214 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.773 ' O ' HG22 ' A' ' 11' ' ' THR . 0.8 OUTLIER -97.74 -154.8 0.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -178.614 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.43 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.0 OUTLIER 34.95 45.96 0.18 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.28 0.632 . . . . 0.0 111.885 179.434 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.773 HG22 ' O ' ' A' ' 9' ' ' ASP . 13.9 t -174.78 -48.37 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.706 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.708 HD22 HD13 ' B' ' 3' ' ' LEU . 28.4 mt -73.82 -42.5 60.82 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 176.228 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.07 -38.58 79.11 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 113.368 -1.742 . . . . 0.0 107.442 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.683 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 2.2 t0 -48.72 -33.8 10.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.014 -1.448 . . . . 0.0 110.198 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.039 HD21 HD13 ' B' ' 34' ' ' LEU . 54.1 mt -69.2 16.67 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -76.23 -61.61 1.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.173 -0.329 . . . . 0.0 110.367 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -83.72 -17.57 40.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.927 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.745 ' CE ' HD23 ' A' ' 15' ' ' LEU . 10.8 mtm -83.01 -28.47 29.64 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.363 0.125 . . . . 0.0 111.294 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.874 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -98.04 -64.13 1.07 Allowed 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.512 -0.516 0 CA-C-O 120.83 0.347 . . . . 0.0 111.774 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.874 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 120.778 0.323 . . . . 0.0 111.737 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 t -116.43 174.17 6.21 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.18 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.477 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -43.58 -38.63 3.07 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -179.179 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.689 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 1.5 m -76.96 -60.36 2.39 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.567 0.347 . . . . 0.0 111.458 -179.126 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.0 mt-10 -58.84 -17.53 24.64 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.995 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.7 tpt -75.94 -47.7 24.11 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 122.757 1.265 . . . . 0.0 108.471 177.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.802 HD13 HD21 ' B' ' 34' ' ' LEU . 0.5 OUTLIER -74.0 -35.72 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 112.7 -2.046 . . . . 0.0 113.214 -177.213 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.421 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.92 -45.85 76.65 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 122.003 0.906 . . . . 0.0 108.882 176.932 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.503 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -58.91 -41.32 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.575 0 CA-C-N 113.387 -1.733 . . . . 0.0 110.282 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.627 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -52.69 -38.27 60.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.99 178.013 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.581 HD12 ' HB ' ' B' ' 11' ' ' THR . 17.8 mt -71.66 -30.41 65.68 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.074 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -79.79 -17.19 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.387 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.56 24.4 4.75 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.71 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -77.51 125.09 28.78 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.72 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.092 -0.956 . . . . 0.0 111.343 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.686 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -88.97 134.76 33.86 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.708 HD13 HD22 ' A' ' 12' ' ' LEU . 2.7 tp -129.34 142.51 50.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.606 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.891 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -125.85 127.5 46.16 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.368 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.462 ' C ' HD12 ' B' ' 5' ' ' ILE . 2.4 pp -154.37 169.56 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.689 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 66.5 t-105 -80.88 113.92 19.41 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.409 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 15.1 tp -144.96 102.26 3.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -178.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.742 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 14.0 p -79.29 178.08 8.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -176.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 9' ' ' ASP . . . . . 0.425 ' HB2' ' NH2' ' A' ' 1' ' ' ARG . 9.3 t70 -51.74 -50.63 60.23 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 113.093 -1.867 . . . . 0.0 112.497 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -47.74 -27.82 2.17 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.657 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 22.2 p -100.32 -22.78 14.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' B' ' 8' ' ' SER . 31.2 mt -79.21 -42.3 26.33 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 178.429 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.498 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.0 mt-10 -62.04 -41.72 98.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.033 -1.439 . . . . 0.0 107.507 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.657 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.75 -45.4 58.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.325 -1.307 . . . . 0.0 109.699 178.171 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.041 HD13 ' HG2' ' B' ' 18' ' ' MET . 1.2 mm? -82.53 22.2 0.89 Allowed 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.655 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.2 OUTLIER -80.34 -47.93 13.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.819 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.655 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 24.3 mtpp -102.92 -10.81 18.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.837 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' MET . . . . . 1.041 ' HG2' HD13 ' B' ' 15' ' ' LEU . 0.1 OUTLIER -105.86 4.64 29.92 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.027 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.852 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -99.76 -15.22 18.54 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.883 -0.51 . . . . 0.0 112.367 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 -77.89 -97.9 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.61 -27.63 62.92 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.922 0.391 . . . . 0.0 110.59 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' B' ' 18' ' ' MET . 24.4 mm-40 -101.95 -21.12 14.58 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 23' ' ' GLY . . . . . 1.028 ' C ' HD13 ' B' ' 24' ' ' LEU . . . -102.51 -20.59 11.73 Favored Glycine 0 N--CA 1.467 0.706 0 C-N-CA 119.907 -1.14 . . . . 0.0 113.09 -179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 1.028 HD13 ' C ' ' B' ' 23' ' ' GLY . 0.0 OUTLIER 44.84 27.96 0.31 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 179.146 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 25' ' ' SER . . . . . 0.738 ' HB2' ' HB2' ' B' ' 28' ' ' GLU . 0.5 OUTLIER 132.1 142.06 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 127.659 2.384 . . . . 0.0 109.449 177.947 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -45.84 -50.8 13.85 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 117.676 0.216 . . . . 0.0 111.206 -178.89 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.546 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 73.4 p -81.43 -35.71 30.31 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.594 0.235 . . . . 0.0 110.869 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.881 ' HB3' ' CD2' ' B' ' 24' ' ' LEU . 13.4 mm-40 -61.72 -26.93 68.36 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.035 179.02 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 29' ' ' MET . . . . . 1.038 ' HE3' HD11 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -68.12 -38.18 81.96 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-O 122.534 1.159 . . . . 0.0 109.263 178.52 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.68 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -80.17 -30.66 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.5 0 CA-C-N 112.999 -1.909 . . . . 0.0 112.837 -175.363 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -44.8 86.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.81 HG21 HD11 ' B' ' 24' ' ' LEU . 2.1 t -58.41 -48.34 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.375 0 CA-C-N 112.422 -2.172 . . . . 0.0 111.854 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.599 ' HB1' ' HB1' ' A' ' 33' ' ' ALA . . . -47.14 -40.57 15.94 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.557 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.039 HD13 HD21 ' A' ' 15' ' ' LEU . 12.3 mt -75.73 -32.11 59.89 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.157 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -78.47 -15.15 58.94 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 25.9 m80 -122.28 6.15 9.67 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.514 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 0.5 OUTLIER -64.7 139.31 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.688 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 123.396 0.678 . . . . 0.0 112.368 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 1.2 ttt-85 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -73.18 123.36 23.49 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 178.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.818 HD22 HD22 ' B' ' 12' ' ' LEU . 2.2 tp -131.01 149.32 52.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.791 -178.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.941 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -118.33 132.32 56.28 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.995 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.848 ' CD1' HG21 ' B' ' 30' ' ' ILE . 3.6 pt -147.53 176.54 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.642 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.2 t-105 -96.57 103.59 15.51 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -177.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.715 HD11 ' CG2' ' B' ' 30' ' ' ILE . 0.7 OUTLIER -131.86 113.63 13.7 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.636 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.689 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 12.6 p -79.17 -176.85 5.35 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.727 0.775 . . . . 0.0 112.707 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -47.16 -60.42 2.49 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.369 -1.287 . . . . 0.0 112.552 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -50.61 -25.88 4.7 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.575 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 23.6 p -94.21 -34.08 13.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.7 mt -65.43 -41.13 93.84 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.42 -43.95 97.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 113.846 -1.524 . . . . 0.0 108.508 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.575 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -55.23 -50.05 70.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.491 179.081 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.003 HD21 HD13 ' B' ' 34' ' ' LEU . 14.2 mt -75.07 17.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 10.3 mm-40 -115.31 -56.35 2.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.1 mttp -76.23 -31.64 58.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.042 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.738 ' HE2' ' CD2' ' A' ' 15' ' ' LEU . 0.7 OUTLIER -97.88 21.12 11.01 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.184 0.516 . . . . 0.0 111.425 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.686 ' HA ' HD21 ' A' ' 24' ' ' LEU . . . -110.97 -64.72 1.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.472 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER . . . . . 0 CA--C 1.514 -0.416 0 CA-C-O 121.162 0.506 . . . . 0.0 111.542 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.716 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.416 0 CA-C-O 121.567 0.699 . . . . 0.0 112.316 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.513 ' N ' HD23 ' A' ' 24' ' ' LEU . 3.3 t -117.65 -179.42 3.73 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.559 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -45.06 -38.2 4.78 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.506 ' O ' HD11 ' B' ' 7' ' ' LEU . 12.0 m -78.01 -62.57 1.63 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.716 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 4.4 mt-10 -59.99 -14.49 16.35 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.902 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.1 tpt -78.44 -47.12 18.16 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 123.791 1.758 . . . . 0.0 107.115 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.047 HG22 HD11 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -64.84 -20.81 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.69 0 CA-C-N 113.065 -1.879 . . . . 0.0 112.19 -179.131 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.39 -52.52 7.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.152 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.862 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -52.05 -33.21 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.848 0 CA-C-O 121.462 0.649 . . . . 0.0 110.395 178.525 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.88 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.2 -43.01 0.33 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.822 -1.535 . . . . 0.0 111.059 178.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.663 HD13 ' CD2' ' B' ' 15' ' ' LEU . 7.1 mt -84.63 -35.2 22.83 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.425 -179.102 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' VAL . 1.6 mt-30 -69.16 -25.6 64.44 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 179.488 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.88 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 6.9 p-80 -101.15 -29.58 12.04 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.712 0.687 . . . . 0.0 112.474 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.649 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 9.1 t80 -50.68 144.07 8.67 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 117.917 -1.04 . . . . 0.0 112.251 178.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.689 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 121.034 0.445 . . . . 0.0 111.809 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 2' ' ' TRP . . . . . 0.41 ' C ' HD22 ' B' ' 3' ' ' LEU . 85.7 m95 -110.06 116.29 31.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.137 177.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.522 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.2 mm? -131.9 150.66 52.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.258 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.941 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -117.17 132.78 56.57 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.579 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.709 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.3 pt -151.52 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.61 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.2 t-105 -94.89 97.02 9.7 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -177.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 1.047 HD11 HG22 ' A' ' 30' ' ' ILE . 2.2 mm? -130.38 108.09 9.73 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 27.5 t -67.96 -125.78 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -176.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' B' ' 11' ' ' THR . 14.4 t70 -101.1 -40.12 7.35 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -176.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -72.34 39.69 0.08 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.706 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 6.5 t -162.19 -41.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.818 HD22 HD22 ' A' ' 3' ' ' LEU . 20.2 mt -74.37 -42.67 58.92 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.23 -37.78 72.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.567 -1.651 . . . . 0.0 108.151 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.706 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.2 t70 -45.38 -33.68 2.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.083 HD22 ' CG ' ' B' ' 29' ' ' MET . 41.5 mt -82.47 27.51 0.5 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -97.71 -51.63 4.03 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -82.84 -17.29 44.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.506 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.488 ' HA ' ' HB2' ' B' ' 22' ' ' GLU . 14.3 mtm -92.23 -70.19 0.71 Allowed 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.314 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.82 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -28.68 -31.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.916 1.286 . . . . 0.0 114.358 -178.138 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.46 ' N ' ' O ' ' B' ' 18' ' ' MET . 9.0 mtp-105 -67.19 -121.71 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.918 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 tpp85 -52.46 -23.96 7.08 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.915 -0.491 . . . . 0.0 111.645 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.488 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 0.8 OUTLIER -108.08 -1.65 20.25 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -177.519 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 23' ' ' GLY . . . . . 0.82 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -151.01 20.43 0.97 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 115.623 -3.179 . . . . 0.0 117.912 -176.842 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.652 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.1 mp 50.26 -157.33 0.09 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 120.108 1.954 . . . . 0.0 113.254 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -64.57 162.65 15.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.681 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.44 -44.58 17.47 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.555 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 14.8 m -82.91 -47.91 11.28 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.165 0.061 . . . . 0.0 111.165 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.471 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 2.6 mt-10 -55.61 -28.31 54.51 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.372 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 29' ' ' MET . . . . . 1.083 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.9 tpt -63.61 -48.69 76.3 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.682 1.229 . . . . 0.0 109.537 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.848 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -77.54 -30.32 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.668 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.877 -176.289 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.455 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -68.51 -48.12 65.2 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.044 177.501 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.455 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.4 t -58.37 -43.85 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-N 113.314 -1.766 . . . . 0.0 110.675 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.87 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -51.34 -32.75 26.68 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.783 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.003 HD13 HD21 ' A' ' 15' ' ' LEU . 11.2 mt -83.82 -28.99 27.67 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.889 -178.258 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -74.51 -16.24 60.84 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.278 0.474 . . . . 0.0 112.278 -179.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.9 m80 -123.05 42.22 3.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.788 0.328 . . . . 0.0 111.104 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.72 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.6 OUTLIER -58.14 133.13 55.33 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.423 0.63 . . . . 0.0 112.108 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.637 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 4.2 tptt . . . . . 0 C--O 1.249 1.072 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.675 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.531 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.795 0 CA-C-O 120.688 0.28 . . . . 0.0 111.718 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -95.19 110.77 22.69 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.417 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 3.0 tp -123.39 145.54 48.69 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.513 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.963 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -117.32 134.99 54.17 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 1.039 ' CD1' HD21 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -157.15 177.68 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.57 ' O ' HD13 ' A' ' 7' ' ' LEU . 69.8 t-105 -91.34 101.04 13.73 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.039 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.4 OUTLIER -125.56 106.59 9.87 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.378 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.429 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.1 t -85.57 -137.0 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.921 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.82 -157.33 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.566 0.209 . . . . 0.0 111.566 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 35.05 43.96 0.12 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.34 0.656 . . . . 0.0 112.247 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.66 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.85 -51.21 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.598 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.453 ' N ' ' CG2' ' A' ' 11' ' ' THR . 16.5 mt -72.22 -40.58 67.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -74.98 -40.9 60.46 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.195 -1.82 . . . . 0.0 107.982 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.66 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -51.44 -27.61 10.77 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 114.625 -1.171 . . . . 0.0 109.948 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.953 HD22 ' HE3' ' A' ' 18' ' ' MET . 0.2 OUTLIER -80.8 36.19 0.38 Allowed 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 124.286 1.035 . . . . 0.0 112.927 -179.684 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -79.79 -59.15 2.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.271 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -101.98 23.42 11.51 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.953 ' HE3' HD22 ' A' ' 15' ' ' LEU . 6.5 mtm -103.85 -86.25 0.45 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.186 -0.321 . . . . 0.0 110.922 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.73 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -45.75 -44.75 14.04 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.088 0.555 . . . . 0.0 111.507 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HD2' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.361 0 CA-C-O 120.993 0.425 . . . . 0.0 111.664 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.73 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 99.2 mt . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.493 0.663 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -120.81 167.79 12.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.334 177.722 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.403 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 2.4 mttm -43.19 -38.61 2.57 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.063 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.722 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.1 m -84.3 -54.76 4.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.5 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.3 mm-40 -62.09 -9.87 8.61 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.191 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.871 ' SD ' HD11 ' A' ' 15' ' ' LEU . 2.5 tpt -87.22 -46.98 9.23 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.616 1.198 . . . . 0.0 108.123 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.9 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.7 OUTLIER -75.56 -34.37 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.127 0 CA-C-N 112.948 -1.933 . . . . 0.0 112.773 -177.83 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.416 HD21 HG21 ' B' ' 11' ' ' THR . 0.2 OUTLIER -65.75 -48.08 73.07 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.327 1.06 . . . . 0.0 108.905 177.524 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.2 t -60.38 -40.81 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 CA-C-N 112.932 -1.94 . . . . 0.0 111.098 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.913 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -46.33 -43.98 16.41 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.885 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.825 HD21 ' HB2' ' B' ' 33' ' ' ALA . 10.5 mt -80.11 -29.41 38.99 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.809 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -66.78 -19.06 65.67 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.33 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -120.7 43.53 2.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.121 0.486 . . . . 0.0 109.908 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.607 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 70.3 t80 -80.74 161.39 24.59 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.777 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.716 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 5.3 mmpt? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.244 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.42 0.153 . . . . 0.0 111.283 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 2' ' ' TRP . . . . . 0.516 ' C ' HD22 ' B' ' 3' ' ' LEU . 91.9 m95 -86.12 121.56 28.9 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.516 HD22 ' C ' ' B' ' 2' ' ' TRP . 2.4 mm? -138.44 153.55 48.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.301 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.963 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -113.27 129.85 56.41 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.223 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.9 ' CD1' HG21 ' A' ' 30' ' ' ILE . 3.9 pt -141.38 173.74 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.722 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 71.4 t-105 -99.43 97.71 8.71 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.854 HD21 HG13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -125.3 105.63 9.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.561 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 8.7 p -79.41 -164.36 0.63 Allowed 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 121.607 0.717 . . . . 0.0 112.207 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 9' ' ' ASP . . . . . 0.415 ' O ' ' HG3' ' B' ' 13' ' ' GLU . 15.9 m-20 -64.47 -44.23 91.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.285 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -64.06 5.68 0.23 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.723 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.2 p -125.2 -42.89 1.97 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' B' ' 8' ' ' SER . 25.5 mt -68.86 -40.81 79.1 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.627 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.1 mt-10 -66.33 -40.27 89.78 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.144 176.362 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.723 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.09 -36.7 30.49 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.836 178.574 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.169 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.35 31.19 0.34 Allowed 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.298 -179.492 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.474 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 4.5 pt-20 -79.52 -46.41 17.44 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.416 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 3.7 ptpp? -108.36 -4.8 17.1 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.699 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.663 ' HB2' HD13 ' B' ' 15' ' ' LEU . 22.1 mtp -83.89 -74.23 0.38 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.898 0.317 . . . . 0.0 111.812 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.977 ' HB2' HD12 ' B' ' 15' ' ' LEU . . . -26.61 -33.87 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.789 1.636 . . . . 0.0 114.015 -177.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' B' ' 18' ' ' MET . 8.7 mtp-105 -66.9 -114.13 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.193 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -58.92 -21.35 57.66 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.576 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 2.4 mt-10 -113.0 -5.86 13.77 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 23' ' ' GLY . . . . . 0.775 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -143.92 16.55 2.17 Favored Glycine 0 CA--C 1.502 -0.72 0 C-N-CA 116.442 -2.79 . . . . 0.0 116.719 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.631 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.2 mp 52.74 -162.51 0.09 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 119.271 1.536 . . . . 0.0 112.926 176.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.8 m -62.48 157.69 19.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.102 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -40.42 23.49 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 117.594 0.179 . . . . 0.0 111.149 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -77.55 -50.34 12.78 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.619 0.247 . . . . 0.0 110.558 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.482 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 0.8 OUTLIER -58.19 -30.91 66.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.278 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 29' ' ' MET . . . . . 1.169 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.3 tpt -63.4 -46.13 87.83 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 123.854 1.787 . . . . 0.0 108.752 177.404 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.952 HG22 HD11 ' A' ' 7' ' ' LEU . 0.4 OUTLIER -67.65 -15.96 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.151 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.998 -177.385 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.54 -47.43 12.16 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 176.316 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.823 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -57.79 -32.88 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.212 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.656 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 1.046 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.17 -43.91 1.13 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 113.899 -1.5 . . . . 0.0 110.884 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.941 HD13 ' CD2' ' A' ' 15' ' ' LEU . 8.8 mt -80.64 -31.05 36.62 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.437 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' B' ' 32' ' ' VAL . 29.4 mt-30 -87.14 -12.8 45.94 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 1.046 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -118.34 6.39 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 179.526 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.74 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -78.28 141.83 38.24 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.901 0.48 . . . . 0.0 110.468 179.547 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.461 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.903 -1.046 . . . . 0.0 112.039 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.531 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -72.4 124.35 24.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.895 HD22 HD22 ' B' ' 12' ' ' LEU . 1.4 tp -131.27 149.41 52.58 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.745 -178.451 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -117.95 128.47 54.83 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.991 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.933 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.6 pt -145.35 173.91 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.48 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 75.1 t-105 -98.83 108.99 21.82 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.73 HD11 HD12 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -124.94 121.38 34.3 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.709 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.854 ' C ' HD23 ' A' ' 12' ' ' LEU . 15.6 p -80.84 178.73 8.2 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-O 121.704 0.764 . . . . 0.0 110.885 -179.292 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -59.63 -43.26 93.9 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.932 -178.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -78.25 40.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 111.642 -179.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.729 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 10.3 t -174.75 -51.73 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.961 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.913 HD22 ' HB2' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -58.52 -30.41 67.04 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.33 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -92.88 -37.1 12.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.042 -1.436 . . . . 0.0 109.216 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.729 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.3 t70 -45.41 -35.32 3.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.517 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.033 HD21 HD13 ' B' ' 34' ' ' LEU . 45.6 mt -58.12 -11.31 2.46 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.24 -61.51 1.98 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -63.65 -21.53 66.43 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.726 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.879 ' SD ' HD23 ' A' ' 15' ' ' LEU . 7.0 mtp -83.89 -76.42 0.29 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.01 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.704 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.89 -43.06 2.93 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.028 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 mtp85 . . . . . 0 CA--C 1.517 -0.316 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.179 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.704 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 97.8 mt . . . . . 0 N--CA 1.45 -0.464 0 CA-C-O 121.583 0.706 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -114.84 166.73 11.45 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.425 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.64 -39.09 3.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 p -84.09 -52.92 5.9 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.482 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.5 mm-40 -62.48 -11.29 15.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.45 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.849 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.3 tpt -87.69 -48.28 7.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.41 1.576 . . . . 0.0 107.324 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.937 HG22 HD11 ' B' ' 7' ' ' LEU . 0.6 OUTLIER -68.08 -24.09 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.555 0 CA-C-N 113.571 -1.65 . . . . 0.0 112.143 -179.071 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.17 -46.4 28.7 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 177.155 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.837 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -57.43 -36.09 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.975 0 CA-C-O 121.57 0.7 . . . . 0.0 109.658 178.397 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.912 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -37.04 -47.27 0.72 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.193 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.073 HD13 HD21 ' B' ' 15' ' ' LEU . 7.8 mt -83.36 -28.86 28.68 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.967 -178.232 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -86.64 -10.56 53.57 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.912 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -128.96 15.94 6.28 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.649 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -81.89 142.51 32.43 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.118 0.567 . . . . 0.0 109.54 178.505 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.463 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.164 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.881 178.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.913 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 2' ' ' TRP . . . . . 0.409 ' C ' HD22 ' B' ' 3' ' ' LEU . 95.6 m95 -87.83 116.73 26.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.53 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -132.34 155.82 47.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.549 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -122.23 130.66 53.39 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.569 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.764 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.4 pt -150.63 -178.27 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.476 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.7 t-105 -94.6 93.26 7.48 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -177.036 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.937 HD11 HG22 ' A' ' 30' ' ' ILE . 1.6 mm? -125.12 110.76 14.52 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.576 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 25.7 t -68.35 -126.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -103.63 -41.04 6.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -72.35 41.42 0.09 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.847 0.459 . . . . 0.0 111.95 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.701 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 6.6 t -163.44 -43.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.895 HD22 HD22 ' A' ' 3' ' ' LEU . 22.8 mt -72.65 -41.65 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.43 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.1 mt-10 -74.23 -36.04 63.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.346 -1.752 . . . . 0.0 108.541 176.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.701 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.3 t70 -46.72 -36.45 7.19 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.496 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.073 HD21 HD13 ' A' ' 34' ' ' LEU . 47.5 mt -71.51 -2.75 17.9 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.43 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.6 OUTLIER -72.3 -36.99 69.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.922 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -91.79 -9.68 42.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.426 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.701 ' HE2' ' HB3' ' A' ' 34' ' ' LEU . 6.6 mtm -100.42 -76.46 0.55 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.105 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.668 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -41.09 -44.36 2.45 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 122.595 0.358 . . . . 0.0 111.4 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.498 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.6 mmm180 -64.03 -68.57 0.34 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.028 0.442 . . . . 0.0 111.901 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -52.6 -29.68 27.21 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.252 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -90.55 -8.56 49.93 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.43 7.61 73.56 Favored Glycine 0 C--N 1.342 0.871 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.897 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.668 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.0 mt -85.67 172.88 10.53 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.525 0.679 . . . . 0.0 111.42 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -110.25 165.06 12.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.482 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.9 -41.97 12.07 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.48 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 74.6 m -84.84 -48.19 9.6 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.717 0.266 . . . . 0.0 111.717 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -64.81 -10.29 26.9 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.596 0.236 . . . . 0.0 111.223 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' MET . . . . . 1.072 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.8 tpt -85.89 -47.51 9.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.933 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -73.54 -35.15 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.065 0 CA-C-N 113.092 -1.867 . . . . 0.0 113.151 -178.527 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.586 HD21 HG21 ' A' ' 11' ' ' THR . 0.2 OUTLIER -65.67 -47.2 76.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.384 1.088 . . . . 0.0 109.165 177.811 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 1.5 t -59.49 -45.23 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.051 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.885 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.61 -37.2 12.09 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.764 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.033 HD13 HD21 ' A' ' 15' ' ' LEU . 10.9 mt -81.43 -27.86 34.51 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -81.28 -13.67 58.21 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -178.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -117.46 29.67 7.74 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 118.002 0.365 . . . . 0.0 111.865 178.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.525 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 24.0 t80 -124.16 157.55 34.45 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.792 0.329 . . . . 0.0 111.649 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.464 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.016 -0.992 . . . . 0.0 112.164 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 120.367 0.127 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -82.83 120.89 26.22 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.5 mm? -131.18 151.39 51.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.625 -178.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.928 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -128.59 123.86 34.42 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.501 178.989 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.954 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.0 pt -146.76 176.18 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -178.354 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.623 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.9 t-105 -95.65 102.46 14.26 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -177.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.829 HD11 HG22 ' B' ' 30' ' ' ILE . 0.9 OUTLIER -129.63 112.08 13.33 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.839 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.571 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 11.2 p -79.65 -178.27 6.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.895 0.855 . . . . 0.0 112.697 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -49.6 -56.43 10.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.8 -1.546 . . . . 0.0 113.036 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -44.96 -33.81 2.16 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.912 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t -96.87 -22.23 17.02 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 8' ' ' SER . 66.2 mt -73.66 -39.9 64.11 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 175.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.72 -40.17 96.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.452 175.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.912 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t0 -50.42 -45.49 55.8 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.466 177.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.941 HD21 HD13 ' B' ' 34' ' ' LEU . 19.3 mt -89.75 30.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.833 179.438 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.571 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -113.53 -50.36 2.85 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.839 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.571 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 53.6 mttm -88.66 -29.92 19.55 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.145 179.317 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.506 ' O ' ' HG3' ' A' ' 18' ' ' MET . 1.1 ptt? -99.13 15.94 24.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.682 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.523 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -99.57 -18.73 17.22 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 . . . . . 0 C--N 1.317 -0.831 0 O-C-N 121.428 -0.795 . . . . 0.0 110.107 -179.595 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.628 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 122.654 1.216 . . . . 0.0 114.214 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -55.81 152.86 9.14 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.002 -1.454 . . . . 0.0 110.602 179.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -41.79 2.95 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 120.571 0.224 . . . . 0.0 111.208 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.613 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.1 m -76.64 -51.38 11.67 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.568 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.4 mt-10 -54.53 -35.74 63.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.693 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.901 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -59.36 -45.58 91.01 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.802 1.763 . . . . 0.0 108.845 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.002 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -66.36 -20.79 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.711 0 CA-C-N 112.953 -1.931 . . . . 0.0 112.713 -177.998 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.552 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -80.39 -47.76 13.93 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.348 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.83 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -58.74 -32.08 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.095 0 CA-C-O 121.681 0.753 . . . . 0.0 109.138 178.468 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 1.055 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.1 -47.15 1.51 Allowed 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 113.741 -1.572 . . . . 0.0 111.225 178.015 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.093 HD13 HD21 ' B' ' 15' ' ' LEU . 9.3 mt -81.53 -25.02 36.26 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.74 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.433 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -91.78 -8.62 46.24 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 1.055 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -125.78 16.31 8.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.732 0.413 . . . . 0.0 111.965 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.778 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -87.9 137.53 32.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.118 0.567 . . . . 0.0 111.686 -179.194 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.601 -0.714 . . . . 0.0 111.324 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -81.43 120.48 25.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' B' ' 3' ' ' LEU . 2.8 mm? -128.45 145.17 51.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.659 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.928 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -124.4 123.16 39.56 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.484 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.897 ' CD1' HG21 ' A' ' 30' ' ' ILE . 2.6 pt -147.76 -179.35 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.101 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.614 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.1 t-105 -98.98 102.51 14.26 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -176.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 1.002 HD11 HG22 ' A' ' 30' ' ' ILE . 1.8 mm? -129.44 109.56 11.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 13.2 t -78.23 -132.5 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 9' ' ' ASP . . . . . 0.86 ' O ' HG22 ' B' ' 11' ' ' THR . 0.8 OUTLIER -90.7 -155.52 0.39 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.575 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 10' ' ' GLN . . . . . 0.457 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.8 mm-40 37.73 45.71 0.67 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.579 0.751 . . . . 0.0 112.637 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.86 HG22 ' O ' ' B' ' 9' ' ' ASP . 9.3 t -179.17 -47.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.936 178.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.495 HD11 ' O ' ' B' ' 7' ' ' LEU . 38.4 mt -69.17 -40.3 78.21 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -68.98 -39.12 79.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.275 176.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.732 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 3.2 t70 -47.96 -33.67 8.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.539 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.093 HD21 HD13 ' A' ' 34' ' ' LEU . 57.9 mt -64.68 -5.3 5.43 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.47 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 14.5 mt-10 -62.4 -55.87 23.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.228 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.3 pttm -79.78 1.11 27.98 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.154 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 18' ' ' MET . . . . . 1.013 ' HE2' HD23 ' B' ' 15' ' ' LEU . 12.0 mtm -107.43 -83.11 0.54 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 111.609 0.226 . . . . 0.0 111.609 -179.154 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.744 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -43.53 -43.61 5.6 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 16.6 mtp85 -70.2 -66.0 0.65 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.976 0.417 . . . . 0.0 111.461 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.26 -32.45 37.27 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.283 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' B' ' 18' ' ' MET . 21.9 mm-40 -88.44 -10.54 48.8 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.295 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.86 7.3 80.69 Favored Glycine 0 C--N 1.339 0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.502 -178.095 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.744 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 96.2 mt -80.27 171.51 14.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.578 0.704 . . . . 0.0 111.408 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -112.19 165.0 12.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.404 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.6 -40.0 5.43 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.0 m -83.32 -52.23 6.74 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.428 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.2 mt-10 -63.79 -11.04 23.36 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.756 -0.202 . . . . 0.0 110.958 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.983 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.0 tpt -85.16 -47.05 10.51 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 122.742 1.258 . . . . 0.0 107.704 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.954 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.6 OUTLIER -75.13 -32.59 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.04 0 CA-C-N 112.889 -1.959 . . . . 0.0 113.216 -178.008 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.32 -50.45 39.07 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.121 0.962 . . . . 0.0 109.449 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.428 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.4 t -55.97 -42.9 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 113.219 -1.809 . . . . 0.0 110.264 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.941 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -49.44 -30.88 8.72 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.288 -1.323 . . . . 0.0 112.232 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.941 HD13 HD21 ' A' ' 15' ' ' LEU . 10.8 mt -89.66 -32.88 16.85 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -177.202 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -72.12 -13.45 61.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -116.52 40.84 2.8 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.632 ' HD1' ' CE1' ' A' ' 36' ' ' HIS . 63.0 t80 -83.5 163.73 20.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.9 -178.479 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.563 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.282 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.846 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.063 0.459 . . . . 0.0 111.757 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -105.01 113.79 27.6 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.4 tp -122.71 142.57 50.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.944 -178.257 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.841 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -123.68 129.58 51.34 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.121 178.486 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.76 HD11 HG21 ' B' ' 30' ' ' ILE . 2.1 pt -148.67 179.22 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.407 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.422 ' O ' ' HB3' ' B' ' 27' ' ' SER . 71.1 t-105 -96.2 90.41 5.48 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.736 HD21 ' CD1' ' A' ' 5' ' ' ILE . 1.9 mm? -119.16 101.26 7.87 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.512 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.46 ' HA ' ' HB2' ' B' ' 1' ' ' ARG . 51.6 p -74.76 -135.2 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.187 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.44 -156.68 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.338 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 34.32 43.68 0.09 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.355 0.662 . . . . 0.0 112.465 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.704 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -172.19 -48.88 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.932 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 7' ' ' LEU . 15.3 mt -75.85 -41.25 52.96 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -77.17 -39.99 46.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.317 176.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.704 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -51.05 -24.75 4.09 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.078 178.549 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.199 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -77.45 41.96 0.33 Allowed 'General case' 0 N--CA 1.424 -1.767 0 C-N-CA 124.24 1.016 . . . . 0.0 112.637 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.687 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -91.15 -47.91 7.26 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.342 179.926 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.687 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 5.3 mtpm? -102.88 24.8 10.14 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.212 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.638 ' HB2' HD13 ' A' ' 15' ' ' LEU . 16.6 mtp -116.51 -86.05 0.62 Allowed 'General case' 0 C--O 1.223 -0.34 0 O-C-N 122.172 -0.33 . . . . 0.0 111.201 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.708 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -42.0 -45.43 3.85 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.133 0.573 . . . . 0.0 111.188 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HD2' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.382 0 CA-C-O 121.147 0.498 . . . . 0.0 111.476 179.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.708 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 98.4 mt . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.579 0.704 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -116.96 168.6 10.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.371 177.465 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.437 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -45.41 -37.89 5.5 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.066 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.437 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 58.8 m -80.39 -57.39 3.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.442 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HB3' HD22 ' A' ' 24' ' ' LEU . 1.8 mm-40 -60.75 -16.21 37.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.137 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' MET . . . . . 1.199 ' SD ' HD11 ' A' ' 15' ' ' LEU . 2.4 tpt -82.15 -45.61 14.92 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-O 123.704 1.716 . . . . 0.0 107.853 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.807 HG21 HG12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -66.2 -19.48 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.99 0 CA-C-N 113.355 -1.748 . . . . 0.0 111.615 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.439 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -78.1 -53.29 7.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.91 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -51.69 -32.51 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.711 0 CA-C-O 121.584 0.707 . . . . 0.0 109.548 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.872 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -40.05 -43.39 1.57 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.93 -1.486 . . . . 0.0 111.064 177.552 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.897 HD22 HD21 ' B' ' 15' ' ' LEU . 6.8 mt -80.67 -29.08 36.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.824 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' A' ' 32' ' ' VAL . 44.9 mt-30 -79.08 -30.69 44.03 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.872 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 22.1 p80 -92.05 -35.67 13.8 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 119.049 0.841 . . . . 0.0 111.895 178.721 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.67 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 8.1 t80 -46.53 140.44 4.34 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.607 0.242 . . . . 0.0 111.179 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.468 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 117.972 -1.013 . . . . 0.0 112.108 178.03 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.46 ' HB2' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.384 0.135 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -82.32 119.45 24.14 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -126.37 134.25 51.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.525 -178.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.841 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -112.25 131.01 55.73 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.032 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.807 HG12 HG21 ' A' ' 30' ' ' ILE . 2.5 pp -153.73 169.98 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.581 ' O ' HD12 ' B' ' 7' ' ' LEU . 73.7 t-105 -89.04 100.44 13.22 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -178.086 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.802 HD13 HD13 ' B' ' 5' ' ' ILE . 1.9 mp -135.17 114.66 12.56 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.846 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -91.93 -169.86 2.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.095 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -43.41 -60.09 1.86 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.126 -1.397 . . . . 0.0 112.869 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.58 -24.72 0.94 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.642 ' HB ' HD12 ' A' ' 34' ' ' LEU . 20.4 p -103.34 -27.41 12.47 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' B' ' 8' ' ' SER . 35.7 mt -74.22 -40.57 62.36 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.547 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -62.73 -41.04 98.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.34 176.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.616 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -48.91 -40.41 29.88 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.522 179.132 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.032 HD22 ' CG ' ' B' ' 29' ' ' MET . 26.3 mt -78.83 32.34 0.2 Allowed 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 44.9 mt-10 -103.1 -55.09 2.48 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.468 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 50.2 mttp -81.49 -25.15 36.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.433 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.837 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 9.5 mtm -86.2 -21.91 27.23 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.3 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.718 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.95 -68.4 0.83 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.828 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -57.8 -66.38 0.48 Allowed 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.011 0.434 . . . . 0.0 112.067 -179.599 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 21' ' ' ARG . . . . . 0.468 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -49.53 -34.18 16.72 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.368 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.52 ' HB2' ' O ' ' B' ' 18' ' ' MET . 20.2 mm-40 -85.08 -10.7 56.59 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.243 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.03 -7.47 81.26 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.752 -178.379 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.718 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 73.8 mt -74.53 173.83 9.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.606 0.717 . . . . 0.0 111.596 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.3 p -119.05 166.01 13.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.582 178.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.67 -39.67 3.73 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' TRP . 1.4 m -84.14 -54.07 5.08 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 121.961 0.104 . . . . 0.0 111.19 -179.72 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.03 -8.79 5.8 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.648 0.261 . . . . 0.0 111.113 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' MET . . . . . 1.032 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.5 tpt -85.91 -47.96 9.16 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.76 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -75.63 -30.92 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.995 0 CA-C-N 113.003 -1.908 . . . . 0.0 113.283 -177.726 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.456 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -69.97 -49.83 47.84 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.263 1.03 . . . . 0.0 109.297 177.629 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.34 -43.13 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.082 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.736 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -46.23 -41.9 13.52 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.563 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.738 HD21 ' HB2' ' A' ' 33' ' ' ALA . 8.5 mt -80.25 -28.62 38.42 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.157 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -70.62 -17.65 62.88 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -119.39 42.98 2.73 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.046 0.45 . . . . 0.0 110.903 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.5 ' HD1' ' CE1' ' A' ' 36' ' ' HIS . 69.6 t80 -55.95 172.63 0.18 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.645 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.429 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.155 0 C-N-CA 123.569 0.748 . . . . 0.0 111.961 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.655 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 120.93 0.395 . . . . 0.0 111.825 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 76.1 m95 -114.91 107.29 15.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.582 177.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -122.15 140.67 52.27 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.294 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -106.94 135.36 48.63 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.486 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.875 HD12 HD21 ' A' ' 7' ' ' LEU . 1.1 pt -151.65 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.602 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.3 t-105 -95.12 89.37 5.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.875 HD21 HD12 ' A' ' 5' ' ' ILE . 1.6 mm? -129.24 100.94 5.78 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.592 ' O ' HG22 ' A' ' 11' ' ' THR . 12.7 p -69.67 -171.55 0.4 Allowed 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 122.028 0.918 . . . . 0.0 112.651 -177.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.31 -39.16 82.16 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.209 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.636 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 31.2 mt-30 -75.63 42.19 0.22 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.679 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.676 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 1.3 t -169.3 -31.87 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.85 HD22 HD22 ' B' ' 3' ' ' LEU . 16.7 mt -82.77 -43.08 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 177.14 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.9 -29.19 18.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.554 -1.657 . . . . 0.0 110.015 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.676 ' HB2' ' N ' ' A' ' 11' ' ' THR . 14.4 t70 -46.46 -13.58 0.02 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.709 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.014 HD11 HD13 ' B' ' 34' ' ' LEU . 0.0 OUTLIER -140.14 46.45 1.84 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 179.224 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 6.3 mt-10 -49.67 -28.61 6.13 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 178.595 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -71.8 -48.12 48.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.989 ' HE3' ' HG ' ' A' ' 15' ' ' LEU . 16.0 mtm -59.08 -28.75 66.77 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.698 0.285 . . . . 0.0 111.331 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.77 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -98.79 -60.32 1.56 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.0 mtp85 . . . . . 0 CA--C 1.517 -0.311 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.892 HD12 ' O ' ' A' ' 18' ' ' MET . 82.9 mt . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 121.686 0.755 . . . . 0.0 111.512 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' A' ' 29' ' ' MET . 52.2 p -117.43 165.47 13.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.025 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 mttm -47.7 -37.88 13.99 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.585 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.2 m -85.55 -50.81 6.94 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.16 -11.32 8.56 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.939 0.149 . . . . 0.0 111.055 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.829 ' HG2' HD21 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -84.27 -42.31 15.99 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.029 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.772 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -77.28 -39.63 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.254 0 CA-C-N 112.901 -1.954 . . . . 0.0 113.269 -176.974 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.432 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -58.01 -46.2 85.65 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.325 1.059 . . . . 0.0 108.337 176.914 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.432 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -58.81 -43.48 88.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.062 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.804 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -60.46 -38.13 83.21 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.796 178.865 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.018 HD13 HD21 ' B' ' 15' ' ' LEU . 16.7 mt -70.3 -26.68 63.9 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.181 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.521 ' HG2' ' CE1' ' A' ' 36' ' ' HIS . 0.6 OUTLIER -78.74 -30.19 45.67 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.129 -178.441 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.521 ' CE1' ' HG2' ' A' ' 35' ' ' GLN . 1.9 m80 -120.1 32.74 5.9 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.543 0.61 . . . . 0.0 111.375 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.576 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -83.26 132.21 35.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 122.476 -0.14 . . . . 0.0 110.657 179.326 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.548 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.483 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.526 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -78.81 116.63 19.27 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.85 HD22 HD22 ' A' ' 12' ' ' LEU . 1.7 tp -138.44 148.96 44.99 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.241 -178.532 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -107.04 134.93 49.44 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.399 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.828 ' CD1' HD21 ' B' ' 7' ' ' LEU . 4.3 pt -136.83 170.46 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.72 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.2 t-105 -97.11 102.33 14.08 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.382 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.828 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.4 OUTLIER -131.81 113.16 13.16 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.662 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.655 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 15.7 p -76.18 -173.9 2.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 112.025 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -48.52 -62.12 1.66 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.352 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -50.85 -28.89 10.43 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.61 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 69.3 p -88.01 -32.63 18.72 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' B' ' 8' ' ' SER . 67.9 mt -68.64 -40.45 80.29 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 177.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.85 -42.72 98.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 113.538 -1.664 . . . . 0.0 107.771 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.639 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -55.51 -46.74 76.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.092 178.589 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.028 HD22 ' CG ' ' B' ' 29' ' ' MET . 15.0 mt -73.24 25.89 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 43.5 mt-10 -111.49 -56.59 2.36 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.68 -29.57 61.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.845 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 21.4 mtm -82.99 -22.35 33.69 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.772 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.717 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.73 -69.06 0.78 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.558 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.4 mtp85 -55.53 -64.24 0.91 Allowed 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.255 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.33 -32.44 17.18 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.192 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' B' ' 18' ' ' MET . 3.8 mm-40 -89.68 -4.92 57.52 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.403 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.26 -11.02 61.83 Favored Glycine 0 C--N 1.34 0.768 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.953 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.717 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 74.8 mt -72.07 172.75 9.53 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.743 0.782 . . . . 0.0 111.685 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 89.8 p -119.87 164.28 16.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.253 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.418 ' HB3' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -43.55 -36.05 1.93 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.35 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.437 ' CB ' ' H ' ' A' ' 6' ' ' TRP . 1.4 m -83.51 -56.48 3.72 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 122.221 0.208 . . . . 0.0 111.363 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.471 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.3 mt-10 -62.48 -8.56 6.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.495 178.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 29' ' ' MET . . . . . 1.028 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.3 tpt -86.0 -48.59 8.53 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.754 HD11 HD11 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -73.08 -35.12 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.044 0 CA-C-N 112.966 -1.925 . . . . 0.0 112.976 -178.051 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.435 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -66.55 -49.41 66.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 122.021 0.915 . . . . 0.0 109.155 177.503 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -57.3 -42.33 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 113.393 -1.73 . . . . 0.0 111.932 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.806 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -48.86 -39.68 26.65 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.429 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.014 HD13 HD11 ' A' ' 15' ' ' LEU . 9.2 mt -76.65 -35.83 57.73 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.196 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -72.93 -11.12 60.46 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -106.87 -50.53 3.09 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.947 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.615 ' CD2' ' SD ' ' A' ' 18' ' ' MET . 12.0 t80 -44.12 144.58 0.92 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.264 0.352 . . . . 0.0 110.9 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.47 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.012 -0.995 . . . . 0.0 112.14 178.172 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 120.933 0.397 . . . . 0.0 111.881 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.403 ' C ' HD22 ' A' ' 3' ' ' LEU . 98.4 m95 -89.02 122.83 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.044 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.497 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 3.2 mm? -130.08 153.8 48.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.896 -178.586 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' B' ' 3' ' ' LEU . 0.5 OUTLIER -127.76 129.72 47.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.409 178.898 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.825 HD12 HD21 ' A' ' 7' ' ' LEU . 1.3 pt -148.11 -179.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.694 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.574 ' C ' HD22 ' A' ' 7' ' ' LEU . 71.7 t-105 -95.06 91.32 6.29 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -177.264 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.825 HD21 HD12 ' A' ' 5' ' ' ILE . 1.8 mm? -127.46 104.05 7.69 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.451 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.674 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 8.4 t -75.5 -137.4 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 120.557 0.218 . . . . 0.0 110.916 -178.789 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.483 ' O ' HG22 ' A' ' 11' ' ' THR . 1.9 p-10 -84.27 -155.76 0.2 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.963 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.409 ' O ' ' HB ' ' A' ' 11' ' ' THR . 2.1 tt0 36.01 43.11 0.19 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.505 0.722 . . . . 0.0 112.675 178.885 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.727 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -173.03 -45.38 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.725 178.681 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.644 HD11 ' O ' ' A' ' 7' ' ' LEU . 18.1 mt -78.37 -40.74 35.42 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 175.981 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -38.84 26.91 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 113.187 -1.824 . . . . 0.0 108.315 177.606 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.727 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -48.97 -26.47 2.54 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.009 -1.451 . . . . 0.0 110.898 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.94 HD11 ' CE ' ' A' ' 18' ' ' MET . 0.4 OUTLIER -82.13 24.29 0.66 Allowed 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.475 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -66.14 -40.3 90.52 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 122.249 -0.282 . . . . 0.0 110.259 178.97 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -105.78 -13.68 15.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.94 ' CE ' HD11 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -106.49 5.17 29.03 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 -179.015 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -98.76 -20.95 16.62 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 178.139 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.401 ' HB2' ' NH1' ' A' ' 20' ' ' ARG . 4.4 mtp-105 . . . . . 0 C--N 1.319 -0.741 0 O-C-N 121.62 -0.675 . . . . 0.0 110.112 -179.332 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.578 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 0.6 OUTLIER . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 122.358 1.075 . . . . 0.0 113.483 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -58.66 158.04 8.45 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.833 177.806 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.14 -40.76 5.21 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.231 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.4 ' CB ' ' H ' ' B' ' 6' ' ' TRP . 3.9 m -77.77 -49.67 13.91 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.482 0.182 . . . . 0.0 111.277 179.991 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.578 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 9.5 mt-10 -55.96 -33.58 64.91 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.353 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.856 ' SD ' ' HG ' ' A' ' 15' ' ' LEU . 5.4 tpt -59.95 -51.91 67.67 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 123.18 1.466 . . . . 0.0 108.848 177.686 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.882 HG21 HD13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -69.39 -29.81 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.587 0 CA-C-N 112.938 -1.937 . . . . 0.0 113.974 -177.265 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.44 -49.46 48.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.198 0.999 . . . . 0.0 108.882 176.706 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.491 HG21 HD11 ' A' ' 24' ' ' LEU . 1.4 t -56.33 -42.26 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.307 0 CA-C-N 113.093 -1.867 . . . . 0.0 111.434 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.895 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -48.44 -43.33 34.29 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.106 179.169 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.027 HD13 ' CD2' ' B' ' 15' ' ' LEU . 11.7 mt -70.73 -29.7 66.02 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.943 -178.141 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -76.92 -23.27 52.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.435 ' HB3' ' HB2' ' B' ' 38' ' ' LYS . 37.0 m80 -118.87 7.83 11.61 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 178.816 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.665 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.4 OUTLIER -61.96 138.05 58.32 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.168 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 117.883 -1.056 . . . . 0.0 112.334 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.674 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 2.1 ttt85 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -72.45 125.07 26.5 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.56 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.549 HD22 HD22 ' A' ' 12' ' ' LEU . 2.4 tp -126.37 141.24 51.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.732 -178.479 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.498 ' O ' HG23 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -119.82 131.8 55.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.343 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.046 ' CD1' HD21 ' B' ' 7' ' ' LEU . 1.2 pp -157.19 173.05 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 121.05 0.452 . . . . 0.0 112.142 -178.434 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.646 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.8 t-105 -88.61 109.52 20.16 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.962 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 1.046 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.4 OUTLIER -130.91 122.02 26.22 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.085 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 33.7 t -78.03 -126.57 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -178.68 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 9' ' ' ASP . . . . . 0.514 ' O ' ' HB3' ' B' ' 13' ' ' GLU . 12.4 t70 -105.06 -44.05 4.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.195 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.42 39.82 0.1 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.118 0.485 . . . . 0.0 111.618 -179.412 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.744 ' OG1' HD12 ' A' ' 34' ' ' LEU . 5.1 t -159.5 -41.34 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 179.76 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.929 HD21 ' HB2' ' B' ' 7' ' ' LEU . 50.3 mt -72.96 -41.86 63.99 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 176.729 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' B' ' 9' ' ' ASP . 0.1 OUTLIER -73.37 -38.29 65.74 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.196 -1.82 . . . . 0.0 107.365 176.793 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.688 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.2 t70 -47.74 -36.89 12.18 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.743 -1.571 . . . . 0.0 110.45 179.066 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.027 ' CD2' HD13 ' A' ' 34' ' ' LEU . 45.7 mt -68.71 -10.92 59.23 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -179.592 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.35 -59.62 4.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.662 0.268 . . . . 0.0 110.927 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.57 -19.04 64.45 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.91 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.734 ' CE ' HD23 ' B' ' 15' ' ' LEU . 39.1 mtm -89.98 -77.01 0.41 Allowed 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.247 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.515 ' HA ' ' OE2' ' B' ' 22' ' ' GLU . . . -37.09 -41.52 0.37 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.138 0.575 . . . . 0.0 112.324 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -68.91 -71.02 0.24 Allowed 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.847 0.356 . . . . 0.0 111.497 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -29.81 45.79 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.08 179.326 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.67 ' CD ' HD12 ' B' ' 24' ' ' LEU . 3.9 pt-20 -83.71 -15.72 47.62 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.482 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.52 12.02 84.69 Favored Glycine 0 C--N 1.344 1.008 0 C-N-CA 121.214 -0.517 . . . . 0.0 114.011 178.416 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.67 HD12 ' CD ' ' B' ' 22' ' ' GLU . 65.1 mt -102.35 175.18 5.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.553 0.692 . . . . 0.0 111.668 -179.481 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 68.5 p -106.3 164.56 11.92 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.904 -1.043 . . . . 0.0 109.749 178.502 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.05 -39.04 1.12 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.352 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.526 ' O ' HD11 ' A' ' 7' ' ' LEU . 1.2 m -81.15 -59.44 2.65 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 122.028 0.131 . . . . 0.0 111.3 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -57.76 -14.87 6.5 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.726 0.298 . . . . 0.0 110.922 179.036 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.98 ' CG ' HD22 ' B' ' 15' ' ' LEU . 1.7 tpt -78.41 -46.28 20.26 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 122.73 1.252 . . . . 0.0 107.996 177.743 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.903 HD11 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.45 -29.7 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.109 0 CA-C-N 112.918 -1.946 . . . . 0.0 113.66 -177.605 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.528 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -70.26 -49.99 44.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.325 1.059 . . . . 0.0 109.009 177.329 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -56.71 -43.73 79.92 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 CA-C-N 112.958 -1.928 . . . . 0.0 110.967 -179.378 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.758 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -45.54 -39.34 7.34 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.341 179.072 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.895 HD23 ' CB ' ' A' ' 33' ' ' ALA . 8.8 mt -75.97 -32.25 59.4 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.167 -177.938 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -79.92 -11.41 59.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -125.49 36.96 4.46 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.255 0.55 . . . . 0.0 111.05 177.573 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.742 ' HD1' ' N ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -58.37 130.08 45.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.362 178.86 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.742 ' N ' ' HD1' ' B' ' 37' ' ' TYR . 7.1 mmpt? . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.58 176.051 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.779 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.803 0.335 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.446 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.2 m95 -79.01 166.99 21.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.2 tp -176.76 145.49 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.099 -179.49 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.717 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -102.27 140.42 36.58 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.616 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.955 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.4 pt -148.47 175.46 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.268 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.679 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 75.4 t-105 -101.15 105.75 16.93 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.88 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.772 HD21 HG13 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -127.2 120.28 28.4 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.728 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 t -82.36 -129.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -178.806 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -102.77 -40.96 6.35 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.536 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.89 41.69 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.232 0.539 . . . . 0.0 111.522 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.86 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.0 t -164.41 -44.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.347 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.645 HD21 ' HB2' ' A' ' 7' ' ' LEU . 84.3 mt -63.9 -40.37 96.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.407 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -64.32 -42.13 96.46 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.429 -1.714 . . . . 0.0 108.132 176.403 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.86 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.3 OUTLIER -51.38 -41.33 60.61 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.356 178.244 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.006 HD21 HD13 ' B' ' 34' ' ' LEU . 24.6 mt -83.96 32.72 0.48 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.98 179.789 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -107.57 -69.35 0.85 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? -76.99 -25.69 53.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.405 179.079 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.615 ' HE1' ' HB3' ' B' ' 34' ' ' LEU . 0.9 OUTLIER -94.52 8.02 43.6 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.54 179.796 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.516 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -100.29 -17.97 17.04 Favored 'General case' 0 C--O 1.214 -0.785 0 C-N-CA 122.954 0.502 . . . . 0.0 112.199 178.894 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.814 0 O-C-N 121.592 -0.693 . . . . 0.0 109.866 -179.899 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.565 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 122.606 1.193 . . . . 0.0 114.147 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.06 154.11 13.37 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.516 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -42.69 8.84 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-O 120.438 0.161 . . . . 0.0 111.209 -179.685 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.659 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 5.9 m -75.65 -44.63 41.58 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.919 179.26 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.9 OUTLIER -62.4 -37.32 85.31 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.509 179.513 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.959 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -57.99 -43.52 86.62 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 124.125 1.917 . . . . 0.0 108.36 177.058 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.086 HG21 HD12 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -68.61 -16.3 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.911 0 CA-C-N 112.583 -2.099 . . . . 0.0 112.949 -177.778 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.83 -45.13 11.17 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.901 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.821 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -59.0 -31.4 45.54 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.635 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 1.032 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -38.08 -46.84 1.06 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.319 177.951 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.893 HD13 ' CD2' ' B' ' 15' ' ' LEU . 8.1 mt -82.68 -26.56 31.98 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.653 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -87.84 -13.75 41.29 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -179.789 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 1.032 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -117.9 4.09 12.18 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 179.699 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.648 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.8 t80 -76.56 146.38 38.39 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.8 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.202 179.442 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -90.7 105.1 17.59 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.732 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.45 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 1.9 tp -125.26 145.64 49.9 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.251 -177.77 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.717 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -103.27 136.91 42.17 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 177.627 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.086 HD12 HG21 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -149.53 -175.0 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.015 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.659 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 64.8 t-105 -92.62 91.0 7.35 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.396 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.975 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -125.2 95.08 4.36 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.601 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.779 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 51.2 p -64.73 177.82 0.88 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 121.761 0.791 . . . . 0.0 111.853 -178.377 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -54.19 -52.65 60.55 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.649 -179.744 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -55.68 -26.88 47.11 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -179.169 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.673 ' HB ' HD12 ' A' ' 34' ' ' LEU . 37.1 p -82.97 -30.29 28.38 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.286 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' B' ' 8' ' ' SER . 30.0 mt -73.77 -39.33 64.26 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 178.619 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.8 mt-10 -60.15 -41.29 92.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 113.719 -1.582 . . . . 0.0 107.612 175.906 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.51 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -53.21 -39.91 64.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.192 -1.367 . . . . 0.0 110.537 178.603 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.061 HD22 ' CG ' ' B' ' 29' ' ' MET . 30.9 mt -77.75 28.4 0.17 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.535 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -101.01 -49.58 4.07 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.657 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.535 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 57.0 mttm -84.61 -20.81 30.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.58 179.25 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.888 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.6 mtm -91.93 -21.04 20.79 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.612 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.698 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -102.66 -62.25 1.3 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.253 179.714 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 4.8 mtp-105 -62.21 -64.94 0.77 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.962 0.41 . . . . 0.0 111.691 -179.487 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -33.4 21.83 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.286 179.78 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.516 ' HB2' ' O ' ' B' ' 18' ' ' MET . 22.3 mm-40 -85.77 -11.57 53.19 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.292 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.1 -6.02 84.08 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.791 -178.428 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.698 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.1 mt -74.08 174.69 8.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.57 0.7 . . . . 0.0 111.529 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 23.1 p -116.95 168.88 9.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.665 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -47.52 -41.17 20.45 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.322 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.679 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 80.8 p -84.62 -49.74 8.29 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.889 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.49 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.8 mm-40 -64.35 -7.95 11.41 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.628 0.251 . . . . 0.0 110.77 178.805 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 29' ' ' MET . . . . . 1.061 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.7 tpt -85.88 -48.03 9.12 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 122.741 1.258 . . . . 0.0 107.804 177.504 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.955 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -75.89 -38.0 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.041 0 CA-C-N 112.907 -1.951 . . . . 0.0 113.189 -177.744 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -46.91 83.38 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.324 1.059 . . . . 0.0 109.092 177.967 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.49 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -61.62 -43.41 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.627 -179.104 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.905 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.89 -30.5 4.19 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.932 179.797 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.006 HD13 HD21 ' A' ' 15' ' ' LEU . 12.1 mt -90.44 -30.48 17.32 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -177.145 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.65 -17.33 62.26 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -110.99 39.06 2.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.182 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.568 ' HD2' ' CE1' ' A' ' 36' ' ' HIS . 51.0 t80 -86.08 160.02 19.4 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.792 -178.61 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.2 mppt? . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.576 178.351 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.505 ' CB ' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.934 0.397 . . . . 0.0 111.807 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -87.23 165.07 15.96 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.697 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.655 HD22 HD22 ' B' ' 12' ' ' LEU . 2.6 tp -167.94 147.12 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.631 -179.411 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.713 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -125.26 135.77 52.87 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.969 178.97 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.929 HD12 HG21 ' B' ' 30' ' ' ILE . 0.3 OUTLIER -151.22 -174.84 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -178.724 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.78 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 67.5 t-105 -97.03 95.57 7.89 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.817 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.825 HD11 ' CG2' ' B' ' 30' ' ' ILE . 1.2 mm? -126.78 103.72 7.68 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.55 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.804 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.2 OUTLIER -95.84 -171.38 2.33 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.636 0.732 . . . . 0.0 112.661 -177.442 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -43.3 -56.44 3.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.227 -1.351 . . . . 0.0 112.367 -178.985 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -50.03 -28.51 7.14 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.159 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.696 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 19.8 p -97.39 -28.49 13.99 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.406 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 8' ' ' SER . 21.4 mt -75.49 -40.94 56.62 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 178.835 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.525 ' O ' ' HB3' ' A' ' 16' ' ' GLU . 2.9 mt-10 -65.79 -40.31 91.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 113.766 -1.561 . . . . 0.0 108.076 176.103 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.696 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -47.55 -45.29 26.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.59 179.039 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.855 HD12 ' HB2' ' A' ' 19' ' ' ALA . 3.5 mm? -77.43 16.73 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -178.542 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.57 ' CG ' ' HG2' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -74.12 -46.9 39.73 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.632 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.57 ' HG2' ' CG ' ' A' ' 16' ' ' GLU . 1.5 mmtm -96.88 1.95 51.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.612 179.029 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.733 ' HB2' HD13 ' A' ' 15' ' ' LEU . 5.0 mtm -108.06 -74.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.983 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.855 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -53.46 -50.7 64.74 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.572 0.349 . . . . 0.0 111.827 -178.911 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.51 -0.592 0 CA-C-O 121.14 0.495 . . . . 0.0 110.481 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.744 HD23 ' C ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.378 0 CA-C-O 121.184 0.516 . . . . 0.0 111.959 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.8 p -96.82 164.32 12.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.446 178.936 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 29' ' ' MET . 10.9 mttm -46.2 -32.14 2.84 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.763 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.626 ' HA ' HD12 ' B' ' 5' ' ' ILE . 6.7 p -77.2 -50.55 12.7 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.853 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 32' ' ' VAL . 10.8 mt-10 -55.74 -24.43 35.14 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.851 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.819 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -78.12 -42.33 32.28 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 121.925 0.869 . . . . 0.0 109.029 178.658 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.766 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -78.25 -23.15 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.477 0 CA-C-N 114.195 -1.366 . . . . 0.0 113.359 -176.699 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.465 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.2 OUTLIER -72.87 -53.34 11.67 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.749 0.785 . . . . 0.0 109.13 176.288 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.585 HG12 ' O ' ' A' ' 28' ' ' GLU . 12.7 p -61.99 -30.89 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.962 0 CA-C-N 114.128 -1.396 . . . . 0.0 112.594 -177.673 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.777 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -42.37 -37.69 1.63 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.451 177.879 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.128 HD13 HD23 ' B' ' 15' ' ' LEU . 8.4 mt -87.89 -29.37 20.92 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.837 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -69.72 -59.46 2.93 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -177.523 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.783 ' NE2' ' HB2' ' B' ' 37' ' ' TYR . 9.7 p-80 -56.93 -36.16 69.91 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 119.158 0.89 . . . . 0.0 111.973 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.739 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 10.4 t80 -42.17 145.73 0.35 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 -177.499 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.249 1.039 0 C-N-CA 124.279 1.031 . . . . 0.0 112.769 178.299 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.804 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 120.992 0.425 . . . . 0.0 111.829 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -108.93 116.19 31.52 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 177.55 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.497 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.12 144.66 51.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.388 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.713 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.02 133.35 56.11 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.502 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 27' ' ' SER . 0.9 OUTLIER -149.59 -177.71 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.468 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -91.17 87.64 6.61 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -177.094 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.766 HD11 HG22 ' A' ' 30' ' ' ILE . 1.9 mm? -119.81 101.43 7.88 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.814 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.505 ' HA ' ' CB ' ' A' ' 1' ' ' ARG . 48.0 t -67.05 -117.69 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.67 -178.188 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.24 -147.35 0.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.266 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 10' ' ' GLN . . . . . 0.473 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.5 tm0? 34.36 44.4 0.1 Allowed 'General case' 0 C--N 1.346 0.43 0 C-N-CA 123.847 0.859 . . . . 0.0 113.202 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.669 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.0 OUTLIER -177.48 -46.5 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.436 178.971 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.655 HD22 HD22 ' A' ' 3' ' ' LEU . 27.1 mt -73.47 -40.65 63.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.789 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -76.95 -37.46 55.23 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 113.297 -1.774 . . . . 0.0 108.161 176.309 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.669 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -52.32 -20.07 2.5 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.029 178.322 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.128 HD23 HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -71.63 43.96 0.09 Allowed 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 125.172 1.389 . . . . 0.0 112.21 179.323 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -86.73 -58.72 2.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.938 179.537 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -98.02 22.57 9.19 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.261 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.786 ' HB2' HD13 ' B' ' 15' ' ' LEU . 0.5 OUTLIER -103.15 -84.68 0.46 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.663 179.75 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.579 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -49.0 -41.75 35.51 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.018 0.527 . . . . 0.0 111.185 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 mtt-85 -64.35 -67.77 0.41 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.965 0.412 . . . . 0.0 111.078 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -32.65 44.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.969 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' B' ' 18' ' ' MET . 37.8 mt-10 -82.66 -17.15 45.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.945 179.747 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.09 9.41 86.97 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -177.301 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 95.3 mt -88.62 171.48 10.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.555 0.742 . . . . 0.0 111.769 -179.445 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 87.5 p -110.53 163.34 13.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.074 177.578 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -43.25 -38.55 2.62 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.214 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.78 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 69.5 m -83.2 -52.14 6.85 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.631 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.44 -11.58 44.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.132 0.491 . . . . 0.0 110.562 178.916 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.986 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.9 tpt -81.59 -45.25 16.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 177.306 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.929 HG21 HD12 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -74.52 -25.79 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.689 0 CA-C-N 112.58 -2.1 . . . . 0.0 112.872 -178.13 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.538 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.45 -50.37 69.99 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.842 0.829 . . . . 0.0 109.282 177.508 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.538 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 14.0 p -74.44 -31.26 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.788 -1.551 . . . . 0.0 113.572 -176.868 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.83 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -53.96 -38.41 64.95 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 122.121 0.962 . . . . 0.0 109.235 177.469 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.027 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -77.77 -41.29 38.01 Favored 'General case' 0 N--CA 1.399 -3.009 0 CA-C-N 113.878 -1.51 . . . . 0.0 110.738 -178.768 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 35' ' ' GLN . . . . . 1.027 ' N ' HD13 ' B' ' 34' ' ' LEU . 5.5 mt-30 -57.12 -62.19 1.93 Allowed 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.186 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.83 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.9 p-80 -53.33 -32.51 49.37 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.854 1.206 . . . . 0.0 110.778 179.695 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.783 ' HB2' ' NE2' ' A' ' 36' ' ' HIS . 62.8 t80 -61.94 160.01 13.08 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.306 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.59 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 10.5 mmmt . . . . . 0 C--O 1.248 0.987 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.85 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.644 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.018 0.437 . . . . 0.0 111.828 . . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.406 ' C ' HD22 ' A' ' 3' ' ' LEU . 82.3 m95 -114.94 114.6 25.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.132 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.486 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -131.98 154.98 48.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.421 -178.866 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.937 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -124.38 131.55 53.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.788 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.878 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -146.02 176.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.364 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.46 ' C ' HD22 ' A' ' 7' ' ' LEU . 74.0 t-105 -97.88 97.76 9.23 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.155 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.775 HD21 ' CD1' ' A' ' 5' ' ' ILE . 1.5 mm? -121.68 112.16 18.07 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 177.08 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.445 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.4 p -80.16 -145.94 0.05 OUTLIER 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 120.786 0.327 . . . . 0.0 111.411 -178.647 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.69 ' O ' HG22 ' A' ' 11' ' ' THR . 2.5 p-10 -75.87 -159.82 0.12 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.953 -179.087 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.46 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 tt0 36.11 44.87 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.487 0.715 . . . . 0.0 112.62 179.048 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.755 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 12.4 t -176.01 -43.98 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.087 179.167 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.573 HD21 ' HB2' ' A' ' 7' ' ' LEU . 27.8 mt -71.03 -42.28 69.74 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 175.943 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -68.15 -39.5 82.63 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 113.286 -1.779 . . . . 0.0 107.521 176.017 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.755 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.1 t70 -50.21 -36.33 30.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.274 178.803 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.986 ' CD2' HD13 ' B' ' 34' ' ' LEU . 51.3 mt -66.82 6.08 0.54 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -69.16 -61.93 1.59 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.228 -0.295 . . . . 0.0 110.687 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -77.92 -11.3 59.88 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.908 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 9.6 mtm -93.95 -29.57 15.19 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.261 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.771 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -103.98 -64.49 1.1 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.917 -0.129 . . . . 0.0 111.214 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 . . . . . 0 CA--C 1.515 -0.382 0 CA-C-O 121.149 0.5 . . . . 0.0 111.791 -179.61 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.771 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.7 mt . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 121.561 0.696 . . . . 0.0 111.482 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 96.0 p -118.32 163.11 17.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.59 -1.187 . . . . 0.0 109.674 178.622 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.419 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -39.43 -37.84 0.5 Allowed 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.532 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.631 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 3.4 m -83.98 -56.88 3.44 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.425 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.1 mt-10 -61.87 -9.66 7.37 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.675 0.274 . . . . 0.0 110.437 179.017 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.908 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.6 tpt -85.64 -48.34 8.97 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 122.742 1.258 . . . . 0.0 108.057 178.083 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.086 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.03 -39.87 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 112.887 -1.96 . . . . 0.0 112.873 -177.796 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.422 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -60.71 -46.25 91.11 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 122.215 1.007 . . . . 0.0 108.647 177.462 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.422 ' N ' HD22 ' A' ' 31' ' ' ASN . 1.1 t -59.36 -43.11 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 CA-C-N 113.155 -1.838 . . . . 0.0 110.509 179.844 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.775 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -55.34 -33.33 63.27 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.543 178.466 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.848 HD13 HD21 ' B' ' 15' ' ' LEU . 14.2 mt -77.68 -30.15 51.81 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.044 -178.747 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -80.1 -17.04 53.65 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.244 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -110.59 15.15 22.22 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 178.735 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.48 -166.29 0.1 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 122.942 0.497 . . . . 0.0 109.956 178.823 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HD3' ' N ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.489 1.516 . . . . 0.0 112.606 -178.091 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.375 0.131 . . . . 0.0 111.291 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 2' ' ' TRP . . . . . 0.5 ' C ' HD22 ' B' ' 3' ' ' LEU . 91.8 m95 -84.79 121.25 27.43 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.786 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.5 HD22 ' C ' ' B' ' 2' ' ' TRP . 2.3 mm? -137.36 153.19 50.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 -179.549 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.937 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -115.88 130.57 56.89 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.572 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.086 ' CD1' HG21 ' A' ' 30' ' ' ILE . 4.4 pt -142.4 172.63 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.661 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.673 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.2 t-105 -99.6 104.61 16.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -177.446 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.855 HD11 HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -132.39 114.66 14.61 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.554 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.644 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 10.4 p -77.26 -173.55 2.88 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.636 0.732 . . . . 0.0 112.702 -177.954 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -48.29 -62.93 1.23 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.336 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.69 -28.71 9.55 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.551 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.63 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 74.1 p -86.33 -32.2 21.14 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.713 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' B' ' 8' ' ' SER . 52.2 mt -71.33 -39.91 71.08 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 177.916 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -62.44 -41.67 98.9 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 113.469 -1.696 . . . . 0.0 107.793 175.989 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.7 OUTLIER -54.48 -47.54 72.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.205 178.876 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.848 HD21 HD13 ' A' ' 34' ' ' LEU . 15.2 mt -74.75 27.65 0.09 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -109.15 -55.3 2.43 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.87 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.83 -36.95 41.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.498 178.581 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.714 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 13.6 mtm -73.23 -16.82 61.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.455 178.58 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.812 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.93 -69.17 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.44 -179.485 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -69.41 0.21 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.966 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.46 -32.08 7.26 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.834 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.714 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 2.9 mt-10 -83.86 -24.36 30.9 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.386 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 23' ' ' GLY . . . . . 0.439 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 99.18 64.04 0.84 Allowed Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.224 -0.988 . . . . 0.0 113.916 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.812 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -179.11 -177.62 0.48 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 177.77 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 25' ' ' SER . . . . . 0.588 ' N ' HD23 ' B' ' 24' ' ' LEU . 3.5 t -114.94 174.78 5.8 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.667 -179.149 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.425 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 0.0 OUTLIER -43.84 -38.92 3.56 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.083 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.545 ' HA ' HD12 ' A' ' 5' ' ' ILE . 3.2 p -80.3 -56.0 4.51 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 117.523 0.147 . . . . 0.0 111.351 -179.552 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.683 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.4 mm-40 -62.93 -11.8 21.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.555 0.217 . . . . 0.0 110.534 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.805 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.1 tpt -81.97 -47.6 12.5 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 122.699 1.238 . . . . 0.0 107.736 177.911 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.878 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -74.31 -37.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.11 0 CA-C-N 112.894 -1.957 . . . . 0.0 112.944 -177.846 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -61.57 -48.38 81.23 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 122.26 1.029 . . . . 0.0 108.543 176.9 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.503 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -58.04 -41.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 CA-C-N 113.015 -1.902 . . . . 0.0 111.561 -179.436 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.764 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -53.16 -37.61 62.03 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.902 179.194 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.986 HD13 ' CD2' ' A' ' 15' ' ' LEU . 15.4 mt -75.56 -31.97 60.23 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.774 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -77.82 -17.79 57.05 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.516 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -96.23 -35.28 11.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 121.259 -0.176 . . . . 0.0 110.99 177.796 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.545 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 13.4 t80 -40.89 143.09 0.4 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.651 0.38 . . . . 0.0 111.091 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt . . . . . 0 C--O 1.251 1.139 0 C-N-CA 123.587 0.755 . . . . 0.0 112.299 179.035 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.706 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.5 mpt_? . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.917 0.389 . . . . 0.0 111.518 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 2' ' ' TRP . . . . . 0.415 ' C ' HD22 ' A' ' 3' ' ' LEU . 87.9 m95 -104.68 116.35 31.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.001 178.745 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -133.21 157.4 45.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.72 -179.57 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -113.88 138.41 50.34 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.783 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.572 ' CD1' ' HB2' ' A' ' 7' ' ' LEU . 2.3 pp -154.69 167.5 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.37 0.605 . . . . 0.0 112.351 -178.589 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.521 ' O ' ' HB3' ' B' ' 27' ' ' SER . 68.0 t-105 -79.02 88.69 4.78 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.374 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.615 HD23 HD22 ' B' ' 3' ' ' LEU . 29.9 tp -125.83 84.62 2.29 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.938 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.608 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 47.9 p -63.41 175.39 1.02 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 122.248 1.023 . . . . 0.0 113.631 -177.067 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.99 -44.46 78.61 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 113.186 -1.825 . . . . 0.0 112.709 -179.35 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -40.54 -37.59 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.748 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.762 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.4 t -109.29 -11.03 14.92 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -178.859 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 8' ' ' SER . 66.5 mt -70.05 -38.44 75.82 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 175.881 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.89 -40.79 98.61 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.164 -1.835 . . . . 0.0 107.952 176.018 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.762 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -53.14 -42.99 66.6 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.461 178.497 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.033 HD21 HD13 ' B' ' 34' ' ' LEU . 28.9 mt -75.86 19.71 0.2 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -99.27 -50.24 4.19 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.28 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -81.37 -33.63 32.24 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.712 178.528 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.525 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 25.0 mtm -67.65 -69.92 0.29 Allowed 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.092 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.748 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -37.27 -44.91 0.62 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.558 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.064 0.459 . . . . 0.0 111.309 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.748 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 121.354 0.597 . . . . 0.0 112.346 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.06 169.42 8.45 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.67 -40.2 4.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -179.069 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.808 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 23.9 m -78.08 -56.47 4.45 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.598 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mt-10 -60.54 -18.71 54.02 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.055 0.455 . . . . 0.0 109.838 178.762 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.935 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.2 tpt -71.53 -47.86 52.5 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 123.122 1.439 . . . . 0.0 107.916 177.952 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.059 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -69.61 -28.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.614 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.155 -178.484 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.427 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -67.08 -49.39 65.19 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.937 0.875 . . . . 0.0 108.946 177.052 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.427 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -57.4 -42.42 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.95 -179.905 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.873 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.87 -39.84 54.95 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.038 178.976 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.099 HD13 HD21 ' B' ' 15' ' ' LEU . 13.5 mt -73.45 -28.98 62.25 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.474 -178.32 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.93 -19.76 50.99 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.08 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -104.61 -35.89 7.67 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 178.281 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.576 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.3 t80 -30.79 130.87 0.1 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.0 0.52 . . . . 0.0 112.135 -179.753 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.437 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 117.993 -1.003 . . . . 0.0 112.07 177.956 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.608 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.802 0.334 . . . . 0.0 111.523 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -74.78 145.64 42.77 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.322 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.615 HD22 HD23 ' A' ' 7' ' ' LEU . 1.7 tp -158.05 150.63 22.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.165 -178.85 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.3 m -111.02 140.68 45.35 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.059 HD12 HG21 ' A' ' 30' ' ' ILE . 3.7 pt -148.41 179.8 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.98 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.808 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.3 t-105 -99.96 101.41 12.5 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -177.187 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.829 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -133.47 113.1 12.12 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 177.172 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.706 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -89.84 -165.83 1.44 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.415 0.626 . . . . 0.0 112.302 -178.132 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -47.79 -65.4 0.57 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.774 -178.476 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -49.3 -25.38 2.35 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.532 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.699 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 30.2 p -94.65 -38.89 10.62 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.552 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' B' ' 8' ' ' SER . 74.6 mt -63.93 -40.83 97.36 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 178.412 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.33 -43.18 98.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 113.747 -1.57 . . . . 0.0 107.975 176.298 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.699 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.71 -45.28 70.39 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.332 178.751 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.099 HD21 HD13 ' A' ' 34' ' ' LEU . 18.0 mt -72.72 28.36 0.06 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.343 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.524 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 6.2 mm-40 -109.55 -56.28 2.32 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.16 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.489 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 1.1 mttm -75.86 -25.53 56.27 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 178.698 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.855 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.0 mtm -87.04 -23.35 25.0 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.208 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.717 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.34 -67.63 0.85 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -54.07 -67.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 21' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 4.8 mmm180 -49.01 -32.31 9.05 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.383 179.717 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.4 mm-40 -88.94 -6.64 57.13 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.466 179.808 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.42 -8.07 69.78 Favored Glycine 0 C--N 1.338 0.687 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.814 -178.526 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.717 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.6 mt -74.12 170.91 14.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.668 0.747 . . . . 0.0 111.605 -179.901 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.6 m -118.62 162.7 17.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.37 178.281 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.458 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -40.55 -37.46 0.71 Allowed 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -179.077 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.521 ' HB3' ' O ' ' A' ' 6' ' ' TRP . 0.7 OUTLIER -82.55 -57.56 3.29 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 122.697 0.399 . . . . 0.0 111.689 -179.538 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.53 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.2 mt-10 -61.69 -10.87 9.59 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.34 178.899 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 29' ' ' MET . . . . . 1.031 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.5 tpt -83.71 -47.86 10.74 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.769 1.271 . . . . 0.0 107.836 177.955 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.767 HD13 HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -73.64 -33.25 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.09 0 CA-C-N 112.791 -2.004 . . . . 0.0 113.147 -177.906 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -48.7 56.4 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.94 0.876 . . . . 0.0 109.338 177.394 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.2 t -56.22 -40.3 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-N 113.499 -1.682 . . . . 0.0 110.642 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.722 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -53.63 -32.68 52.33 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.482 179.005 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.033 HD13 HD21 ' A' ' 15' ' ' LEU . 11.3 mt -82.36 -32.83 29.09 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.78 -177.825 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -80.54 -8.42 59.57 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.607 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -112.17 8.21 19.81 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.488 0.185 . . . . 0.0 111.327 177.665 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.544 ' CD2' ' HD2' ' B' ' 38' ' ' LYS . 3.3 t80 -66.3 -169.29 0.07 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.085 0.554 . . . . 0.0 109.6 178.592 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.544 ' HD2' ' CD2' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.363 1.465 . . . . 0.0 112.915 -178.408 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 120.815 0.34 . . . . 0.0 111.864 . . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -98.37 114.6 26.99 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.444 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.548 HD21 HG12 ' A' ' 5' ' ' ILE . 3.2 tp -122.25 142.39 50.51 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.266 -177.931 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.6 OUTLIER -123.76 128.77 50.05 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.663 178.217 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 1.028 HD12 HD21 ' A' ' 7' ' ' LEU . 1.1 pp -155.75 173.71 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -178.076 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.674 ' O ' HD13 ' A' ' 7' ' ' LEU . 74.9 t-105 -95.28 112.64 24.32 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -176.83 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.028 HD21 HD12 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -129.52 122.65 29.65 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.519 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.893 ' C ' HD23 ' A' ' 12' ' ' LEU . 9.8 p -80.31 -173.23 3.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.318 0.58 . . . . 0.0 110.412 -179.802 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -61.93 -162.11 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.201 -178.645 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.495 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.54 40.43 0.12 Allowed 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.635 0.774 . . . . 0.0 112.805 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.718 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 2.0 t -179.78 -56.46 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.002 179.441 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.931 HD22 ' HB2' ' B' ' 1' ' ' ARG . 0.6 OUTLIER -62.61 -29.1 70.36 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 175.831 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.458 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 2.8 mm-40 -92.43 -37.5 12.52 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.609 -1.632 . . . . 0.0 108.692 177.201 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.718 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -45.34 -31.03 1.45 Allowed 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.718 179.472 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.99 HD22 ' CG ' ' A' ' 29' ' ' MET . 43.8 mt -72.47 19.21 0.08 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 179.609 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -95.88 -48.6 5.66 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.217 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -84.63 -38.09 20.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.556 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.461 ' O ' ' N ' ' A' ' 20' ' ' ARG . 17.2 mtm -64.26 -72.69 0.14 Allowed 'General case' 0 C--N 1.341 0.239 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.427 179.466 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.518 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -28.5 -32.17 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.888 1.368 . . . . 0.0 113.934 -178.602 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.505 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 3.7 mmm180 . . . . . 0 C--N 1.31 -1.14 0 C-N-CA 119.729 -0.789 . . . . 0.0 110.35 179.194 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.2 mp . . . . . 0 N--CA 1.454 -0.236 0 CA-C-O 122.319 1.057 . . . . 0.0 113.353 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -60.82 165.21 4.15 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 114.282 -1.326 . . . . 0.0 110.373 178.535 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -43.87 66.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.311 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 m -80.71 -46.92 14.75 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.283 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.576 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 2.5 mm-40 -57.36 -27.49 62.33 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.591 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.99 ' CG ' HD22 ' A' ' 15' ' ' LEU . 4.2 tpt -63.61 -48.3 77.88 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 122.925 1.345 . . . . 0.0 109.109 177.702 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.966 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -77.94 -29.78 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.582 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.128 -176.282 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.75 -50.02 33.83 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.052 0.929 . . . . 0.0 109.459 177.785 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.3 t -57.85 -42.86 83.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.817 -179.488 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.936 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -50.51 -27.71 7.12 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.625 179.154 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.928 HD13 HD21 ' B' ' 15' ' ' LEU . 10.9 mt -91.42 -30.91 16.24 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.922 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -75.7 -14.24 60.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.076 0.398 . . . . 0.0 112.076 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -111.04 35.6 3.48 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.491 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.586 ' CD2' ' N ' ' A' ' 38' ' ' LYS . 67.3 t80 -74.31 162.22 29.11 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.341 -178.735 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.586 ' N ' ' CD2' ' A' ' 37' ' ' TYR . 6.8 mmmt . . . . . 0 C--O 1.251 1.136 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.086 177.794 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.931 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 120.785 0.326 . . . . 0.0 111.878 . . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 2' ' ' TRP . . . . . 0.437 ' C ' HD22 ' B' ' 3' ' ' LEU . 97.6 m95 -89.56 122.46 32.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.834 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 mm? -133.61 151.07 51.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.958 0.409 . . . . 0.0 111.95 -178.605 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -123.78 124.25 42.28 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.257 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.966 ' CD1' HG21 ' A' ' 30' ' ' ILE . 3.8 pt -147.21 176.99 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.794 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.677 ' O ' HD13 ' B' ' 7' ' ' LEU . 70.6 t-105 -96.9 101.82 13.48 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.268 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.904 HD11 HG22 ' A' ' 30' ' ' ILE . 0.7 OUTLIER -130.85 112.26 12.85 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.476 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.582 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 9.8 p -84.76 178.92 7.46 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.029 0.919 . . . . 0.0 113.028 -177.89 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -47.69 -49.15 28.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 113.321 -1.763 . . . . 0.0 112.781 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -43.46 -35.02 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.527 -178.846 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.771 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 3.9 t -112.28 -7.74 13.99 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -179.202 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' B' ' 8' ' ' SER . 73.8 mt -72.88 -38.96 66.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 175.762 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.54 -41.35 98.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.285 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.771 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -52.2 -43.05 64.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.622 178.794 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.928 HD21 HD13 ' A' ' 34' ' ' LEU . 16.5 mt -79.09 22.88 0.38 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.628 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -43.35 4.48 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -80.71 -46.91 14.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.301 0.24 . . . . 0.0 111.524 179.824 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.781 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -81.32 10.04 6.2 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.413 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -111.04 -61.06 1.75 Allowed 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.542 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.492 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 29.9 mmm-85 -62.0 -63.51 1.23 Allowed 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.182 0.515 . . . . 0.0 111.505 179.191 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -34.56 35.35 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.844 179.534 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -80.48 -12.65 59.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.673 179.27 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.59 -12.91 68.69 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.76 -178.666 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.426 HD22 ' HB3' ' B' ' 28' ' ' GLU . 43.4 mt -74.26 175.3 7.72 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.907 0.86 . . . . 0.0 112.22 -179.793 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -118.33 173.29 6.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.166 178.139 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.56 -38.85 60.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 7.3 m -79.79 -52.66 7.64 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.539 0.209 . . . . 0.0 111.029 179.819 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.426 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.7 mm-40 -63.82 -13.52 45.25 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.262 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.786 ' HG2' ' HB3' ' B' ' 15' ' ' LEU . 1.2 tpt -80.84 -45.77 16.37 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 123.714 1.721 . . . . 0.0 107.176 177.129 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 1.022 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.71 -17.91 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.772 0 CA-C-N 112.943 -1.935 . . . . 0.0 111.957 -179.099 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.411 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -80.34 -47.51 14.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.075 176.82 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.754 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.1 OUTLIER -59.25 -30.94 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 CA-C-O 121.665 0.745 . . . . 0.0 108.996 178.549 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 1.034 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -37.42 -44.35 0.63 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 113.722 -1.581 . . . . 0.0 110.924 177.919 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.9 HD22 HD21 ' A' ' 15' ' ' LEU . 9.2 mt -83.78 -30.45 26.59 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.534 -179.392 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 35' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' B' ' 32' ' ' VAL . 66.7 mt-30 -82.89 -15.61 50.8 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.426 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 1.034 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 1.0 OUTLIER -118.3 6.06 11.89 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.974 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.679 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 1.0 OUTLIER -78.49 137.84 38.14 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.172 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.451 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 117.931 -1.033 . . . . 0.0 112.025 178.366 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.881 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 . . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -88.96 118.39 28.65 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.107 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 mm? -131.85 154.76 48.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.73 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -127.03 135.23 50.53 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 178.775 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 1.028 HD13 HD13 ' A' ' 7' ' ' LEU . 2.3 pp -151.12 171.86 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.898 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.62 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 73.2 t-105 -84.76 91.64 8.02 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.036 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.028 HD13 HD13 ' A' ' 5' ' ' ILE . 2.9 mp -131.45 98.68 4.59 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 177.038 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.83 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -74.07 -168.22 0.6 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.525 0.678 . . . . 0.0 112.127 -177.863 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -55.17 -54.39 43.88 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.478 -1.237 . . . . 0.0 113.078 -178.214 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -50.35 -22.58 1.89 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.47 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 15.7 p -96.72 -25.46 15.52 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.718 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 8' ' ' SER . 20.0 mt -78.8 -37.33 41.11 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 178.613 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.96 -41.29 78.04 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 174.985 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.577 ' O ' ' HG3' ' A' ' 18' ' ' MET . 0.1 OUTLIER -55.63 -47.44 76.59 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.683 177.421 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.867 HD21 HD22 ' B' ' 34' ' ' LEU . 22.3 mt -81.32 31.56 0.34 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.829 179.657 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.425 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -113.78 -49.58 2.87 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.687 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.425 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 2.1 ptmm? -88.83 -28.8 20.16 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.613 0.365 . . . . 0.0 111.056 178.577 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.66 ' HE2' HD23 ' A' ' 15' ' ' LEU . 6.9 mtm -87.04 -8.17 57.38 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.567 178.743 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.442 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -89.69 -18.99 25.37 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.063 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' A' ' 16' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.314 -0.946 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.863 -179.485 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.623 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 . . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.66 163.33 3.32 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 113.727 -1.579 . . . . 0.0 110.593 178.692 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -51.13 -43.81 61.24 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.801 0.296 . . . . 0.0 111.801 -179.474 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -77.08 -39.59 49.19 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.543 0.211 . . . . 0.0 111.023 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.623 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.8 mt-10 -64.81 -36.45 84.37 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.282 179.508 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.862 ' HE3' HG23 ' A' ' 32' ' ' VAL . 2.4 tpt -61.3 -44.66 96.84 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 123.96 1.838 . . . . 0.0 108.407 177.445 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.983 HG21 HD13 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -68.28 -18.6 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 112.97 -1.923 . . . . 0.0 112.265 -177.543 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.14 -45.23 16.72 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.168 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.862 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -60.39 -32.33 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.467 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 1.053 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.98 -42.0 1.3 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.163 -1.38 . . . . 0.0 110.536 177.83 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.927 HD22 HD21 ' B' ' 15' ' ' LEU . 9.8 mt -83.12 -29.7 28.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.726 -179.674 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.444 ' N ' ' O ' ' A' ' 32' ' ' VAL . 8.5 mt-30 -87.67 -18.62 29.15 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.489 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 1.053 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -109.44 4.52 22.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.418 0.554 . . . . 0.0 112.412 179.687 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.585 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.9 t80 -79.85 145.61 32.65 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.661 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.477 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.729 -0.653 . . . . 0.0 112.245 179.48 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.83 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.908 0.385 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 2' ' ' TRP . . . . . 0.484 ' O ' ' HD3' ' B' ' 1' ' ' ARG . 99.2 m95 -69.26 174.84 4.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.697 179.896 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.536 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 tp -169.14 137.38 1.95 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -117.16 138.69 51.5 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.683 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.043 HD12 HD21 ' B' ' 7' ' ' LEU . 1.3 pp -161.81 173.63 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.222 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.518 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.7 t-105 -93.0 114.25 26.75 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.463 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 1.043 HD21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -128.97 123.78 33.34 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.561 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.868 ' O ' HD23 ' B' ' 12' ' ' LEU . 11.6 p -81.5 -174.24 4.85 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.839 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -63.3 -163.55 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.808 -178.827 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 10' ' ' GLN . . . . . 0.408 ' O ' ' HB ' ' B' ' 11' ' ' THR . 0.0 OUTLIER 35.37 41.75 0.09 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.447 0.699 . . . . 0.0 112.723 179.014 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.642 ' HA ' ' CB ' ' B' ' 14' ' ' ASP . 0.7 OUTLIER -178.38 -56.15 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.998 179.678 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.881 HD22 ' HB2' ' A' ' 1' ' ' ARG . 1.0 OUTLIER -61.97 -30.38 70.89 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.445 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -95.46 -35.87 11.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.06 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.642 ' CB ' ' HA ' ' B' ' 11' ' ' THR . 6.6 t70 -44.69 -31.17 1.09 Allowed 'General case' 0 C--N 1.343 0.306 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.217 179.779 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.927 HD21 HD22 ' A' ' 34' ' ' LEU . 44.2 mt -67.64 14.69 0.05 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.496 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -83.23 -42.11 17.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.262 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.487 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 5.1 mtpm? -91.37 -21.62 20.9 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.368 179.009 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.872 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 2.6 mtm -83.98 -26.51 29.14 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.586 -179.731 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.744 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.22 -69.51 0.76 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.637 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -53.16 -67.82 0.22 Allowed 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.35 -33.71 14.13 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.365 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.562 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.3 mm-40 -85.5 -11.2 54.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.16 179.703 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.94 -9.1 78.42 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.624 -178.219 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.744 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 60.3 mt -75.76 177.77 6.63 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 121.543 0.687 . . . . 0.0 111.52 179.963 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.1 p -124.51 170.41 10.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.98 -40.59 6.56 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.62 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 3.8 p -85.83 -51.37 6.45 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -179.802 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.579 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.9 mm-40 -64.04 -4.18 3.24 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 121.388 -0.125 . . . . 0.0 111.292 179.579 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.872 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 3.5 tpt -94.33 -50.3 5.31 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 177.666 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.874 HG22 HD11 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -73.59 -36.66 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.911 0 CA-C-N 113.311 -1.768 . . . . 0.0 112.677 -178.426 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.428 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.62 -48.94 65.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.941 0.877 . . . . 0.0 109.441 177.344 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.579 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -59.92 -36.79 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.376 -179.851 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.944 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -50.74 -32.47 19.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.105 179.209 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.867 HD22 HD21 ' A' ' 15' ' ' LEU . 13.4 mt -90.64 -28.92 18.07 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.557 -177.634 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -68.92 -19.66 64.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.49 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -102.84 25.71 8.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.863 0.363 . . . . 0.0 110.382 177.101 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.68 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 1.4 t80 -103.8 144.49 31.42 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.667 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.68 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 2.1 mppt? . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.191 178.159 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.75 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.8 mpt_? . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 120.921 0.391 . . . . 0.0 111.661 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -100.19 121.19 41.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.48 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.507 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -132.44 137.07 47.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.49 -178.63 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.935 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -119.34 128.39 54.07 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.553 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.92 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -151.29 -178.86 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.231 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.423 ' O ' HD13 ' A' ' 7' ' ' LEU . 76.2 t-105 -93.52 96.39 9.84 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -177.097 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.817 HD11 HG22 ' B' ' 30' ' ' ILE . 1.4 mm? -121.54 117.73 27.5 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 176.39 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.696 ' C ' HD23 ' A' ' 12' ' ' LEU . 50.7 p -65.84 165.93 12.04 Favored 'General case' 0 N--CA 1.427 -1.589 0 CA-C-O 122.21 1.005 . . . . 0.0 111.283 -178.336 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.466 ' CG ' ' HG3' ' A' ' 13' ' ' GLU . 5.8 t70 -60.65 -35.74 76.96 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 113.237 -1.801 . . . . 0.0 113.077 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -71.37 32.25 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.629 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.755 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -171.18 -50.26 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 122.881 0.472 . . . . 0.0 111.787 178.618 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.789 ' CD2' ' HD2' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -56.3 -29.83 61.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.836 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.466 ' HG3' ' CG ' ' A' ' 9' ' ' ASP . 3.0 mm-40 -88.28 -38.24 15.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.321 -1.309 . . . . 0.0 108.571 177.393 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.755 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 4.7 t70 -44.72 -24.45 0.2 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.214 178.158 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.94 HD21 HD13 ' B' ' 34' ' ' LEU . 50.1 mt -67.51 14.6 0.05 Allowed 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.325 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.8 mt-10 -87.01 -44.62 11.45 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -79.5 -22.77 43.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.067 178.966 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.986 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 5.0 mtm -90.25 -23.61 21.18 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.047 -179.167 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.748 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -102.3 -65.87 0.96 Allowed 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.4 mtp85 . . . . . 0 N--CA 1.468 0.459 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.013 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.748 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 68.2 mt . . . . . 0 N--CA 1.453 -0.31 0 CA-C-O 121.508 0.671 . . . . 0.0 111.301 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -124.91 172.31 9.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.916 178.755 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.475 ' HB3' ' CG2' ' B' ' 5' ' ' ILE . 0.6 OUTLIER -46.15 -39.8 10.14 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.139 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.689 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 1.3 p -87.87 -50.18 6.61 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.445 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.4 mt-10 -63.58 -6.32 5.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.624 0.249 . . . . 0.0 110.484 178.96 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.986 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.4 tpt -89.73 -50.01 6.31 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-O 122.562 1.173 . . . . 0.0 107.983 178.075 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.084 HG22 HD11 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -73.77 -38.57 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.064 0 CA-C-N 113.202 -1.817 . . . . 0.0 112.444 -178.004 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -61.88 -46.76 88.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 122.091 0.948 . . . . 0.0 108.56 176.684 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.445 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.85 -41.22 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.219 -179.979 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.69 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -53.36 -34.79 58.98 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.656 178.915 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.862 HD13 HD21 ' B' ' 15' ' ' LEU . 10.3 mt -79.38 -29.07 41.91 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.256 -178.874 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -79.16 -16.98 55.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.785 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.9 m80 -102.95 2.61 35.34 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.594 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.663 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 1.9 t80 -67.4 -168.95 0.09 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.543 0.337 . . . . 0.0 111.078 179.718 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.455 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 C-N-CA 125.866 1.666 . . . . 0.0 112.818 -178.535 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.789 ' HD2' ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.819 0.343 . . . . 0.0 111.145 . . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.84 130.57 41.37 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.057 0.456 . . . . 0.0 110.941 -179.266 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -130.57 142.93 50.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.542 -178.859 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.935 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -127.87 132.84 49.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.739 179.108 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.063 HD12 HG21 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -150.27 -175.28 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.465 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.798 ' O ' HD13 ' B' ' 7' ' ' LEU . 76.6 t-105 -103.79 92.32 4.37 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -177.252 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 1.084 HD11 HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -128.45 112.9 14.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.412 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.75 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.2 OUTLIER -86.35 -164.99 1.13 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.764 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -45.27 -66.46 0.4 Allowed 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.067 -1.424 . . . . 0.0 113.691 -178.044 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -47.88 -22.07 0.51 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.275 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.644 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 28.9 p -101.26 -35.5 9.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.433 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' B' ' 8' ' ' SER . 55.1 mt -69.7 -41.06 75.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 178.475 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -60.91 -41.86 96.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.84 -1.527 . . . . 0.0 107.442 175.858 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.644 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.3 OUTLIER -51.83 -39.28 58.55 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.172 178.367 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.862 HD21 HD13 ' A' ' 34' ' ' LEU . 27.0 mt -78.38 29.91 0.18 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.412 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -104.47 -59.51 1.73 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.435 ' HG3' ' N ' ' B' ' 18' ' ' MET . 6.7 pttm -71.32 -21.73 62.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.72 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.871 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 7.5 mtm -91.17 -18.45 24.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.193 -179.866 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.734 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -103.19 -67.15 0.9 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.909 179.101 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -59.98 -66.29 0.54 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 120.914 0.388 . . . . 0.0 112.034 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.7 -33.25 15.39 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 18' ' ' MET . 6.8 mm-40 -85.87 -10.83 54.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.351 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.58 -10.75 73.64 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.9 -178.681 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.734 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 57.4 mt -71.99 177.26 4.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.606 0.717 . . . . 0.0 111.561 179.779 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 37.5 p -123.44 168.04 13.06 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.46 178.784 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.19 -40.82 5.34 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.357 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.861 ' HA ' HD12 ' A' ' 5' ' ' ILE . 2.2 p -83.68 -51.49 7.22 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.402 ' O ' HG12 ' B' ' 32' ' ' VAL . 2.9 mm-40 -63.64 -7.21 6.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.654 0.264 . . . . 0.0 110.816 178.878 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.871 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.7 tpt -89.18 -49.47 6.72 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 177.781 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.92 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -72.35 -27.95 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.288 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.696 -178.335 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.444 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.83 -52.36 37.75 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.627 0.727 . . . . 0.0 109.785 177.204 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.444 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 10.0 p -63.88 -32.65 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.819 -177.392 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.885 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -49.36 -32.05 10.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.892 177.437 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.94 HD13 HD21 ' A' ' 15' ' ' LEU . 14.4 mt -88.72 -26.64 21.68 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.159 -177.121 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -75.84 -27.51 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -177.614 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.885 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 6.4 p-80 -89.43 -33.47 16.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.963 0.801 . . . . 0.0 111.022 177.627 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.433 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 20.4 t80 -35.89 144.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.998 0.519 . . . . 0.0 111.877 -179.533 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt . . . . . 0 C--O 1.25 1.101 0 C-N-CA 123.611 0.765 . . . . 0.0 112.178 178.938 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.584 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 111.652 0.242 . . . . 0.0 111.652 . . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -71.54 123.57 22.75 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.713 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.504 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.2 tp -122.1 132.66 54.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.655 -178.589 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.969 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -117.7 117.92 30.66 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.126 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.888 HD11 HG21 ' B' ' 30' ' ' ILE . 5.5 pt -143.26 176.42 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.827 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.507 ' O ' HD13 ' A' ' 7' ' ' LEU . 74.4 t-105 -98.74 105.25 17.37 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -177.025 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.737 HD11 HG22 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -128.7 123.63 33.57 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.781 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.974 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -86.29 -163.48 0.89 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.171 -179.555 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.708 ' O ' HG22 ' A' ' 11' ' ' THR . 3.1 t70 -63.61 -165.14 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.381 -177.949 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.541 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.7 tt0 36.83 40.68 0.15 Allowed 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.543 0.737 . . . . 0.0 112.761 179.307 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.708 HG22 ' O ' ' A' ' 9' ' ' ASP . 11.2 t 177.39 -51.21 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.274 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.974 HD23 ' C ' ' A' ' 8' ' ' SER . 0.5 OUTLIER -68.44 -30.19 69.01 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.516 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.78 -40.16 12.66 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 113.745 -1.57 . . . . 0.0 107.706 177.577 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.685 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -44.17 -28.88 0.55 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.803 179.266 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.919 HD21 HD13 ' B' ' 34' ' ' LEU . 34.9 mt -69.2 20.21 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.467 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -97.18 -44.32 6.99 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.674 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 21.7 mtpp -87.73 -26.86 22.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.797 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 7.6 mtm -82.39 -14.5 55.11 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.959 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.774 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -100.63 -64.66 1.02 Allowed 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.525 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 . . . . . 0 CA--C 1.516 -0.327 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -178.838 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.774 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 121.099 0.475 . . . . 0.0 111.587 . . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.452 ' N ' HD23 ' A' ' 24' ' ' LEU . 84.5 p -100.19 165.54 11.44 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.414 -178.791 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 1.1 mmmm -48.23 -35.72 12.46 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.471 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.5 m -78.55 -58.33 3.3 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 122.239 0.216 . . . . 0.0 110.781 179.88 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.478 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.0 mm-40 -57.77 -16.84 12.52 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 178.431 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.797 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 0.8 OUTLIER -75.42 -50.33 16.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 122.621 1.2 . . . . 0.0 108.115 177.86 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.79 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -70.63 -34.17 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.122 0 CA-C-N 113.007 -1.906 . . . . 0.0 113.069 -177.697 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.451 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -66.79 -49.03 67.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.046 0.927 . . . . 0.0 108.794 177.023 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.478 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -54.93 -42.1 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.626 -179.702 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.774 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -46.75 -36.15 6.93 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.188 179.367 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 1.097 HD13 ' CD1' ' B' ' 15' ' ' LEU . 10.5 mt -77.56 -37.1 51.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.009 -178.081 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -71.22 -17.05 62.52 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.484 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -107.02 27.23 9.21 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 177.142 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.745 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 9.8 t80 -117.08 146.7 42.95 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.667 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.636 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.1 0 C-N-CA 123.74 0.816 . . . . 0.0 112.117 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.922 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.159 0.504 . . . . 0.0 111.944 . . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -101.87 117.48 34.94 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.953 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.545 HD21 HD11 ' B' ' 5' ' ' ILE . 15.8 tp -108.12 132.88 53.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.531 -177.966 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.969 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -126.91 119.36 26.55 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.212 178.442 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.7 HD12 HD21 ' B' ' 7' ' ' LEU . 1.0 OUTLIER -152.65 -178.23 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.363 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.573 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.1 t-105 -93.49 91.48 7.15 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -177.726 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.79 HD11 HG22 ' A' ' 30' ' ' ILE . 2.1 mm? -128.75 104.14 7.46 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.429 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.584 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 8.8 t -69.66 -135.71 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.891 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -90.23 -38.76 13.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -177.631 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 10' ' ' GLN . . . . . 0.577 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 1.4 mt-30 -73.59 41.83 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.087 0.47 . . . . 0.0 111.717 -179.181 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.736 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 1.1 t -165.27 -37.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 178.826 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.416 ' CD2' HD22 ' A' ' 3' ' ' LEU . 15.4 mt -79.87 -42.87 23.33 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.112 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.35 -30.25 22.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.619 177.576 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.736 ' HB2' ' N ' ' B' ' 11' ' ' THR . 5.6 t70 -41.99 -19.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.002 -1.454 . . . . 0.0 113.333 -179.052 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.097 ' CD1' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -137.14 56.02 1.8 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 179.272 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.579 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 4.1 mt-10 -56.57 -25.27 51.84 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.929 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.695 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 9.1 mttp -84.68 -45.07 12.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.948 179.399 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 18' ' ' MET . . . . . 1.051 ' HE3' ' HG ' ' B' ' 15' ' ' LEU . 20.3 mtm -59.09 -25.89 64.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.796 0.331 . . . . 0.0 110.591 179.614 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.7 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -100.91 -64.82 1.01 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.352 179.581 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.579 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 2.9 mtp85 -67.06 -65.14 0.72 Allowed 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.112 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 21' ' ' ARG . . . . . 0.695 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.96 -34.33 20.51 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.512 -179.859 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.504 ' HB2' ' O ' ' B' ' 18' ' ' MET . 8.8 mm-40 -82.43 -14.53 54.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.017 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.9 -5.98 83.06 Favored Glycine 0 C--N 1.339 0.707 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.702 -178.546 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.778 HD12 ' O ' ' B' ' 18' ' ' MET . 76.6 mt -71.8 177.57 4.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 111.681 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 25' ' ' SER . . . . . 0.485 ' O ' ' HB3' ' B' ' 29' ' ' MET . 25.1 p -119.0 169.33 9.99 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.261 178.418 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.41 -37.66 17.61 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.492 ' HA ' HD12 ' A' ' 5' ' ' ILE . 6.0 p -87.02 -49.76 7.11 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.566 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.459 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.4 mm-40 -61.12 -11.62 9.45 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 121.046 -0.262 . . . . 0.0 111.019 179.686 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.902 ' HG2' HD21 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -85.28 -43.05 14.08 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 176.748 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.888 HG21 HD11 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -78.99 -24.59 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-N 113.616 -1.629 . . . . 0.0 113.789 -176.942 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.523 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -66.26 -53.92 31.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.658 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.523 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 15.0 p -64.29 -32.6 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.673 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.333 -177.69 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.906 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -52.3 -27.97 17.26 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.651 177.195 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.919 HD13 HD21 ' A' ' 15' ' ' LEU . 13.4 mt -90.31 -27.15 19.61 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.416 -178.374 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -69.18 -37.25 78.06 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -178.049 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.906 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 4.5 p-80 -81.77 -41.45 21.16 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 118.952 0.796 . . . . 0.0 110.772 178.309 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 28.3 t80 -48.48 150.24 1.4 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.907 -179.42 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 117.947 -1.025 . . . . 0.0 112.3 178.172 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.713 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.096 0.474 . . . . 0.0 111.914 . . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -110.36 117.21 33.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 177.353 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -127.8 140.93 51.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.725 -177.883 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.923 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -120.73 129.87 53.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.414 178.624 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.612 ' CD1' HG21 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -150.85 -176.94 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.5 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.614 ' C ' HD22 ' A' ' 7' ' ' LEU . 70.9 t-105 -92.69 94.79 9.19 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.591 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.91 HD11 HG22 ' B' ' 30' ' ' ILE . 1.8 mm? -130.36 105.44 7.89 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.3 177.76 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 51.8 p -67.7 -139.18 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.582 0.229 . . . . 0.0 110.941 -178.855 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -99.0 -142.64 0.32 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 119.558 -0.258 . . . . 0.0 111.386 -179.191 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.412 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.0 OUTLIER 33.38 42.11 0.04 OUTLIER 'General case' 0 C--N 1.346 0.445 0 C-N-CA 123.455 0.702 . . . . 0.0 112.67 179.401 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.678 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -176.34 -49.9 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.989 179.488 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.847 HD22 HD22 ' B' ' 3' ' ' LEU . 47.7 mt -71.22 -39.8 71.49 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 176.016 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -40.44 65.0 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 113.134 -1.848 . . . . 0.0 107.04 176.088 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.678 ' CB ' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -49.39 -27.46 4.09 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 113.497 -1.683 . . . . 0.0 110.753 179.108 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.025 HD21 HD13 ' B' ' 34' ' ' LEU . 74.3 mt -63.02 4.52 0.18 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -60.73 -59.04 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 179.49 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.4 pttp -85.76 -9.02 57.76 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.392 178.88 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.574 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 10.7 mtp -88.37 -23.46 23.37 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.944 179.48 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -101.35 -60.62 1.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.567 -179.796 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.6 mtp-105 . . . . . 0 CA--C 1.515 -0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 111.549 -179.716 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.818 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.612 0 CA-C-O 121.153 0.501 . . . . 0.0 111.748 . . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.491 ' N ' HD23 ' A' ' 24' ' ' LEU . 0.7 OUTLIER -110.69 166.88 10.66 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.865 -178.696 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -38.11 -43.29 0.73 Allowed 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -179.271 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.623 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 4.4 m -78.45 -53.39 7.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.733 0.242 . . . . 0.0 111.295 -179.27 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.609 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mt-10 -64.37 -15.2 60.0 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 110.023 178.605 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.697 ' HB2' HD21 ' A' ' 24' ' ' LEU . 2.5 tpt -77.09 -46.93 21.92 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.245 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.098 HG21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.0 -25.92 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.788 0 CA-C-N 112.834 -1.985 . . . . 0.0 112.716 -178.586 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.562 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.44 -51.25 58.87 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.674 0.749 . . . . 0.0 109.241 177.395 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.562 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 12.3 p -66.97 -31.69 54.59 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.679 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.56 -177.866 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.742 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -44.9 -34.07 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.32 177.406 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.808 HD13 HD21 ' B' ' 15' ' ' LEU . 8.8 mt -95.75 -24.92 16.28 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -177.769 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -69.69 -39.76 76.76 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.858 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.742 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -64.12 -34.73 78.71 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.237 0.926 . . . . 0.0 110.225 178.247 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.651 ' CD1' ' N ' ' A' ' 38' ' ' LYS . 0.9 OUTLIER -48.83 141.71 7.16 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.076 -179.629 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.651 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 177.193 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 120.899 0.38 . . . . 0.0 111.571 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -79.42 133.79 36.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.859 179.603 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.847 HD22 HD22 ' A' ' 12' ' ' LEU . 2.2 tp -133.41 144.85 49.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.516 -178.647 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.923 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.3 OUTLIER -128.92 130.3 46.61 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.71 179.077 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 1.098 HD12 HG21 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -150.34 -173.86 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.579 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.623 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 67.0 t-105 -97.91 101.6 13.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.485 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.902 HD11 ' CG2' ' A' ' 30' ' ' ILE . 1.6 mm? -128.27 107.0 9.41 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.499 178.113 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.713 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 11.1 p -79.99 -172.95 3.66 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 121.508 0.671 . . . . 0.0 112.103 -178.492 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -48.96 -58.07 5.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.967 -179.55 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -50.48 -30.79 13.59 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.021 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.663 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 44.2 p -87.57 -34.7 18.47 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.776 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' B' ' 8' ' ' SER . 50.2 mt -68.58 -39.82 80.8 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 178.394 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.11 -41.52 94.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.53 -1.668 . . . . 0.0 108.365 176.496 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.663 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.3 OUTLIER -52.57 -46.44 66.87 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.086 179.036 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.808 HD21 HD13 ' A' ' 34' ' ' LEU . 23.9 mt -77.34 32.31 0.15 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.97 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -105.64 -55.7 2.29 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.226 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -82.13 -24.77 34.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.465 179.214 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.706 ' HE2' HD23 ' B' ' 15' ' ' LEU . 8.0 mtm -85.08 -14.49 47.04 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.688 0.28 . . . . 0.0 110.451 179.294 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.841 ' HA ' HD21 ' B' ' 24' ' ' LEU . . . -99.92 -65.51 0.96 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.026 -179.891 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 22.3 mtp85 -58.56 -63.54 1.25 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.044 0.449 . . . . 0.0 111.502 -179.146 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.46 -34.75 17.59 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.549 179.381 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' B' ' 18' ' ' MET . 3.2 mm-40 -73.22 -28.64 62.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.145 178.907 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.65 -15.67 37.82 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.332 179.663 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.841 HD21 ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -90.64 -172.51 3.42 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.197 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.1 p -114.28 170.73 8.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.699 -179.883 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 3.1 mttm -44.64 -39.77 5.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.428 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 27' ' ' SER . . . . . 0.62 ' O ' HD11 ' A' ' 7' ' ' LEU . 13.2 m -71.94 -62.03 1.57 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.483 0.182 . . . . 0.0 110.906 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.669 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.6 mm-40 -57.95 -17.05 14.54 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.132 179.353 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.743 ' HE3' ' CG2' ' B' ' 32' ' ' VAL . 1.3 tpt -78.07 -45.78 22.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 123.601 1.667 . . . . 0.0 107.565 177.466 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.91 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -67.73 -18.76 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.789 0 CA-C-N 112.845 -1.98 . . . . 0.0 112.21 -177.987 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.71 -44.96 16.37 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.67 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.807 ' HB ' ' CD2' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -60.41 -32.28 50.73 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.659 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 1.02 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -35.74 -40.04 0.17 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 113.656 -1.611 . . . . 0.0 110.967 178.325 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 15' ' ' LEU . 4.0 mt -94.72 -28.38 15.34 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.259 -179.216 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 35' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' B' ' 32' ' ' VAL . 57.0 mt-30 -83.14 -30.13 28.1 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -179.375 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 1.02 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -94.3 19.43 9.48 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 117.909 0.322 . . . . 0.0 111.654 179.446 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.731 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -56.48 129.51 41.04 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -179.721 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.701 ' N ' ' HD1' ' B' ' 37' ' ' TYR . 1.4 mmmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 117.824 -1.084 . . . . 0.0 111.38 176.277 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 111.471 0.175 . . . . 0.0 111.471 . . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -80.58 113.13 18.56 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.465 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.417 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -122.95 141.33 52.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.058 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.63 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -116.96 128.73 55.49 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.975 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.86 HG13 HD21 ' A' ' 7' ' ' LEU . 1.9 pt -151.57 178.51 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.095 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -91.07 89.79 7.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -177.481 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.86 HD21 HG13 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -120.36 102.54 8.54 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.86 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.2 p -67.62 -140.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -177.061 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.406 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.6 t70 -95.28 -38.86 10.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.507 -178.011 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -72.55 39.45 0.08 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.946 0.498 . . . . 0.0 112.039 -179.153 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.841 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -163.59 -43.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.18 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 7' ' ' LEU . 56.6 mt -68.12 -41.26 81.97 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.214 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.05 -38.46 90.91 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 113.416 -1.72 . . . . 0.0 107.917 176.07 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.841 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -51.78 -42.72 62.63 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.996 178.331 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 1.07 HD21 HD13 ' B' ' 34' ' ' LEU . 50.3 mt -73.31 -12.7 60.93 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.744 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.83 -42.31 71.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.62 0.247 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -92.93 -20.94 20.12 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.717 179.325 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.916 ' HE2' HD23 ' A' ' 15' ' ' LEU . 30.9 mtm -87.21 -61.31 1.75 Allowed 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -179.3 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.618 ' HA ' ' HB2' ' A' ' 29' ' ' MET . . . -25.18 -34.5 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 114.214 1.191 . . . . 0.0 114.214 -178.48 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 18' ' ' MET . 31.3 mmm-85 . . . . . 0 C--N 1.315 -0.892 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.797 179.643 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.896 ' CD2' ' HB3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.556 1.195 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 . . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.697 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 1.9 t 131.68 163.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 127.707 2.403 . . . . 0.0 109.495 177.904 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 26' ' ' LYS . 5.4 mtpt -69.24 -48.18 62.64 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.577 179.824 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.412 ' CB ' ' H ' ' B' ' 6' ' ' TRP . 9.6 m -77.95 -30.77 50.56 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.261 178.101 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.896 ' HB3' ' CD2' ' A' ' 24' ' ' LEU . 2.6 mm-40 -73.31 -28.47 62.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.743 179.091 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.974 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.4 tpt -67.87 -46.08 72.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 123.759 1.742 . . . . 0.0 107.896 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.083 HG22 HD11 ' B' ' 7' ' ' LEU . 0.4 OUTLIER -65.75 -18.45 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.037 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.845 -179.371 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -50.33 11.35 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.144 177.084 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.848 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -55.4 -34.47 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 178.562 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 1.007 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -35.56 -46.56 0.41 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.558 -1.655 . . . . 0.0 111.556 178.056 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.998 HD13 ' CD2' ' B' ' 15' ' ' LEU . 6.2 mt -83.5 -32.82 25.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.868 -179.092 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -81.05 -11.74 59.46 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 179.478 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 1.007 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -123.29 -4.93 8.34 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -179.529 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.615 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.7 OUTLIER -62.6 142.17 58.15 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.847 0.459 . . . . 0.0 110.52 179.88 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.863 -1.065 . . . . 0.0 112.262 178.763 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.55 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -73.81 127.3 32.45 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.048 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.1 tp -134.48 137.82 44.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.629 -178.869 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.63 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -111.07 128.54 55.91 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.804 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.995 ' CD1' HG21 ' A' ' 30' ' ' ILE . 4.0 pt -150.62 176.19 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.446 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.577 ' C ' HD22 ' B' ' 7' ' ' LEU . 74.5 t-105 -94.58 104.12 16.06 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.612 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 1.083 HD11 HG22 ' A' ' 30' ' ' ILE . 1.3 mm? -124.08 115.48 21.24 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 176.976 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 28.0 p -73.86 -135.91 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.637 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 9' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 12.9 t70 -96.49 -39.79 9.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -177.755 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -72.29 41.31 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.72 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.645 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 4.7 t -160.57 -44.49 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.307 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.415 HD21 ' HB2' ' B' ' 7' ' ' LEU . 17.6 mt -73.79 -41.9 61.74 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.677 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' B' ' 9' ' ' ASP . 1.9 mt-10 -76.32 -37.98 56.63 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 113.555 -1.657 . . . . 0.0 108.366 176.472 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.645 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -48.8 -32.14 8.21 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.227 178.304 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.998 ' CD2' HD13 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -82.13 32.89 0.39 Allowed 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 124.654 1.182 . . . . 0.0 112.923 179.906 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.557 ' HG2' ' N ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -81.84 -41.92 20.37 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.995 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 17' ' ' LYS . . . . . 0.557 ' N ' ' HG2' ' B' ' 16' ' ' GLU . 24.0 mtpp -115.59 24.07 11.85 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.626 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.7 ' SD ' HD22 ' B' ' 15' ' ' LEU . 35.6 mtp -110.83 -75.53 0.62 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.397 0.141 . . . . 0.0 111.356 -179.831 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.975 ' HB2' ' CD1' ' B' ' 15' ' ' LEU . . . -25.46 -32.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.865 1.666 . . . . 0.0 114.131 -177.913 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' B' ' 18' ' ' MET . 0.0 OUTLIER -62.5 -141.46 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.476 -0.489 . . . . 0.0 109.699 177.944 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 21' ' ' ARG . . . . . 0.468 ' N ' ' CG ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -43.43 -21.94 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.577 -0.702 . . . . 0.0 112.279 179.043 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' B' ' 20' ' ' ARG . 19.5 mm-40 -104.42 -12.93 16.28 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -177.769 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 23' ' ' GLY . . . . . 0.731 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -137.71 12.26 3.69 Favored Glycine 0 CA--C 1.501 -0.79 0 C-N-CA 116.804 -2.617 . . . . 0.0 116.962 -175.713 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' B' ' 19' ' ' ALA . 1.1 mp 53.55 -161.97 0.12 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 119.723 1.762 . . . . 0.0 112.622 177.038 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -64.14 158.85 21.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.438 178.895 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.48 -43.14 11.37 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 117.624 0.193 . . . . 0.0 111.509 -179.608 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -82.69 -50.28 8.89 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.883 -0.144 . . . . 0.0 111.078 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 28' ' ' GLU . . . . . 0.48 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.2 mm-40 -54.07 -30.12 46.91 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.799 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 29' ' ' MET . . . . . 0.867 ' SD ' HD21 ' B' ' 15' ' ' LEU . 3.5 tpt -60.39 -47.58 85.45 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 122.82 1.295 . . . . 0.0 109.821 177.603 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.737 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -79.28 -29.47 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.43 0 CA-C-N 112.407 -2.179 . . . . 0.0 114.056 -175.341 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.58 -48.16 56.64 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.297 1.046 . . . . 0.0 108.931 177.079 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 32' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 2.1 t -58.96 -47.07 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.469 -179.304 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.873 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -45.18 -34.81 2.91 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.804 179.686 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 1.07 HD13 HD21 ' A' ' 15' ' ' LEU . 13.6 mt -83.78 -30.46 26.58 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.398 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -80.36 -9.19 59.74 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.951 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -120.43 25.86 9.54 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 120.71 0.29 . . . . 0.0 111.153 177.961 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.596 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 22.1 t80 -132.96 163.55 28.94 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.744 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.595 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.5 tppt? . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.137 178.757 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.211 0.053 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -79.69 120.17 23.63 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.998 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.479 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.7 mm? -131.48 153.63 49.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.494 -178.995 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.894 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -126.65 127.56 45.37 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.329 178.829 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.838 HD11 HG21 ' B' ' 30' ' ' ILE . 2.7 pt -145.32 176.49 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.446 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.483 ' C ' HD22 ' A' ' 7' ' ' LEU . 73.3 t-105 -96.2 95.06 7.87 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.156 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.799 HD21 HD12 ' A' ' 5' ' ' ILE . 1.3 mm? -124.9 108.23 11.69 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.298 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.0 p -72.37 -136.79 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.535 0.207 . . . . 0.0 111.07 -178.867 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.681 ' O ' HG22 ' A' ' 11' ' ' THR . 1.7 t70 -88.14 -156.46 0.36 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 119.798 -0.144 . . . . 0.0 110.932 -179.535 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.15 44.1 0.09 Allowed 'General case' 0 C--N 1.346 0.413 0 C-N-CA 123.229 0.611 . . . . 0.0 112.089 179.24 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.697 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 7.8 t -172.65 -46.45 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.714 179.673 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.741 HD21 ' HB2' ' A' ' 7' ' ' LEU . 34.5 mt -73.57 -42.58 61.44 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 175.774 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.96 -39.61 83.34 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 113.323 -1.762 . . . . 0.0 107.081 175.657 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.697 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.9 t70 -49.46 -30.69 8.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.015 -1.448 . . . . 0.0 110.415 178.581 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.988 HD21 HD13 ' B' ' 34' ' ' LEU . 45.6 mt -73.51 22.73 0.07 Allowed 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.703 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -83.85 -66.1 0.93 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 122.17 -0.332 . . . . 0.0 110.551 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.75 -15.22 60.3 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.712 179.528 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.792 ' CE ' HD23 ' A' ' 15' ' ' LEU . 15.7 mtm -87.1 -27.37 23.16 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.37 -179.861 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.82 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -102.13 -59.38 1.71 Allowed 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.354 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.513 -0.475 0 CA-C-O 120.902 0.382 . . . . 0.0 111.601 -179.171 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.85 HD21 ' HB2' ' A' ' 29' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 120.922 0.391 . . . . 0.0 111.9 . . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.657 ' N ' HD23 ' A' ' 24' ' ' LEU . 19.3 p -113.76 169.6 8.87 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.779 -178.655 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.533 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -37.48 -42.4 0.51 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -179.385 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.692 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 29.2 p -72.42 -62.46 1.43 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.363 0.265 . . . . 0.0 111.586 -179.644 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mm-40 -58.56 -13.16 5.04 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.594 179.074 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.85 ' HB2' HD21 ' A' ' 24' ' ' LEU . 2.6 tpt -82.39 -48.25 11.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 122.736 1.255 . . . . 0.0 108.302 178.311 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.702 HD13 HD21 ' B' ' 34' ' ' LEU . 0.6 OUTLIER -74.51 -36.24 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.106 0 CA-C-N 112.806 -1.997 . . . . 0.0 112.916 -177.696 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -47.04 81.37 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.136 0.969 . . . . 0.0 108.75 176.864 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.96 -42.3 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 113.239 -1.801 . . . . 0.0 111.422 -179.584 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.746 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.82 -42.27 58.26 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.443 179.622 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.877 HD13 HD23 ' B' ' 15' ' ' LEU . 9.4 mt -73.76 -34.32 64.65 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.617 -178.037 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -74.46 -13.57 60.72 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -107.85 -40.1 5.36 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 177.983 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.623 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.4 t80 -29.33 133.02 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.038 0.535 . . . . 0.0 111.963 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.058 178.147 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 1' ' ' ARG . . . . . 0.475 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 . . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -78.97 122.37 26.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 178.963 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 3' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -130.57 152.5 49.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.334 -179.271 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 4' ' ' CYS . . . . . 0.894 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -125.67 128.31 47.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.532 178.956 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.492 ' CD1' HG21 ' A' ' 30' ' ' ILE . 2.3 pp -151.21 169.45 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-O 121.037 0.446 . . . . 0.0 112.118 -178.801 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.692 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 68.4 t-105 -81.19 90.51 6.08 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.74 0.781 . . . . 0.0 111.29 -179.594 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.637 ' HG ' HG23 ' B' ' 11' ' ' THR . 12.7 tp -107.17 95.39 5.68 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 178.537 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 8' ' ' SER . . . . . 0.57 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 6.0 p -81.34 -157.94 0.19 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.96 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -66.08 -41.57 90.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.913 -178.125 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -74.33 42.28 0.15 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.147 0.499 . . . . 0.0 111.346 -179.54 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 11' ' ' THR . . . . . 0.722 ' OG1' HD12 ' A' ' 34' ' ' LEU . 9.5 t -167.83 -43.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -179.822 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 12' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' B' ' 8' ' ' SER . 28.1 mt -69.9 -41.65 74.41 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.26 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 13' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' B' ' 16' ' ' GLU . 2.7 mt-10 -73.97 -41.35 62.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.37 -1.741 . . . . 0.0 108.187 176.582 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 14' ' ' ASP . . . . . 0.639 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -49.07 -27.31 3.25 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.091 178.519 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 1.033 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.57 40.56 0.59 Allowed 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 124.134 0.974 . . . . 0.0 112.385 179.883 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' B' ' 13' ' ' GLU . 7.1 mt-10 -74.59 -66.82 0.69 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.475 179.823 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -107.89 33.39 4.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.231 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 18' ' ' MET . . . . . 0.643 ' HB2' HD13 ' B' ' 15' ' ' LEU . 3.2 mtm -105.36 -84.52 0.5 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 122.322 -0.236 . . . . 0.0 110.684 179.679 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.758 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -48.49 -49.27 36.45 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.26 0.624 . . . . 0.0 111.693 179.873 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -61.33 -65.4 0.7 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.156 0.503 . . . . 0.0 111.26 -179.639 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -32.52 27.79 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.28 179.368 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 22' ' ' GLU . . . . . 0.527 ' HB2' ' O ' ' B' ' 18' ' ' MET . 18.5 mm-40 -91.22 -6.8 52.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.22 4.45 68.54 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.295 -0.955 . . . . 0.0 111.666 -178.03 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 24' ' ' LEU . . . . . 0.758 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.1 mt -78.92 169.48 18.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.501 0.667 . . . . 0.0 111.174 179.911 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 92.5 p -112.24 161.06 17.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.477 178.036 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.38 -37.14 0.96 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.48 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.5 m -83.26 -58.12 2.97 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.644 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -59.09 -13.85 8.2 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.496 178.944 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 29' ' ' MET . . . . . 1.033 ' SD ' HD11 ' B' ' 15' ' ' LEU . 3.3 tpt -80.76 -47.17 14.3 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 122.679 1.228 . . . . 0.0 108.494 178.059 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.838 HG21 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -75.94 -28.97 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.206 0 CA-C-N 112.794 -2.003 . . . . 0.0 113.219 -177.319 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.575 HD21 HG21 ' A' ' 11' ' ' THR . 0.3 OUTLIER -68.2 -48.55 64.9 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 122.329 1.062 . . . . 0.0 108.668 177.105 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.97 -48.28 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.577 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.794 -179.533 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 33' ' ' ALA . . . . . 0.762 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -47.76 -38.49 15.61 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.49 179.051 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.988 HD13 HD21 ' A' ' 15' ' ' LEU . 11.6 mt -74.67 -31.07 61.81 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.957 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -82.69 -13.82 55.7 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.111 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -124.78 21.66 8.3 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.786 0.327 . . . . 0.0 111.4 177.889 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.558 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 0.6 OUTLIER -81.1 131.79 35.32 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.66 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.458 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.121 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 178.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.991 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 120.982 0.42 . . . . 0.0 111.968 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -96.0 118.99 33.7 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 4.5 tp -118.54 134.84 54.78 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.228 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.762 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -124.46 127.57 47.69 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.085 178.535 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.821 ' CD1' HG21 ' B' ' 30' ' ' ILE . 1.1 pt -152.91 -176.51 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.749 ' O ' HD13 ' A' ' 7' ' ' LEU . 71.4 t-105 -97.03 93.15 6.42 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -177.038 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.902 HD11 HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -128.04 109.34 11.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 177.392 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.749 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 9.1 p -79.13 -176.29 5.05 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -43.39 -59.12 2.25 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 113.769 -1.559 . . . . 0.0 112.992 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -47.43 -26.25 1.29 Allowed 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.625 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 21.9 p -101.25 -29.41 12.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 8' ' ' SER . 43.6 mt -73.54 -40.68 63.79 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 178.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.99 -40.71 94.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.551 175.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.625 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -52.8 -48.22 67.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.282 -1.326 . . . . 0.0 109.282 178.131 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.95 HD21 HD13 ' B' ' 34' ' ' LEU . 15.6 mt -71.61 9.92 0.76 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.473 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -102.53 -48.62 4.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.561 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.473 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 30.3 mttm -72.25 -40.8 67.43 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.017 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.708 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 43.4 mtm -68.97 -63.81 0.99 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.714 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.651 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -47.46 -49.48 25.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.745 0.418 . . . . 0.0 111.676 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' GLU . 15.9 mtp85 -58.26 -67.58 0.34 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.013 0.435 . . . . 0.0 111.627 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -30.84 22.76 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.153 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 18' ' ' MET . 20.2 mm-40 -88.36 -8.6 54.8 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.358 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.2 7.16 76.73 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 120.454 -0.879 . . . . 0.0 111.376 -177.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 95.5 mt -85.66 169.3 13.6 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.632 0.73 . . . . 0.0 111.561 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 m -114.01 166.05 11.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.335 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.9 -40.1 1.3 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.625 ' HA ' HD12 ' B' ' 5' ' ' ILE . 1.5 m -84.13 -54.2 4.99 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 111.532 0.197 . . . . 0.0 111.532 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.54 ' HB3' HD22 ' A' ' 24' ' ' LEU . 2.3 mm-40 -61.69 -10.74 9.31 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 120.722 0.296 . . . . 0.0 111.063 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.889 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.6 tpt -83.59 -47.32 11.41 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.69 1.233 . . . . 0.0 107.719 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.027 HG21 HD11 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -74.5 -31.53 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 CA-C-N 113.114 -1.857 . . . . 0.0 113.397 -178.167 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.431 ' OD1' HG21 ' B' ' 11' ' ' THR . 0.1 OUTLIER -65.54 -46.9 77.78 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.414 1.102 . . . . 0.0 108.555 177.201 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.402 ' N ' HD22 ' A' ' 31' ' ' ASN . 2.2 t -58.97 -47.37 90.03 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.595 0 CA-C-N 112.752 -2.022 . . . . 0.0 111.048 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.686 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -48.8 -37.69 19.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.29 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.1 HD13 HD21 ' B' ' 15' ' ' LEU . 13.4 mt -77.98 -29.74 49.86 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.973 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -79.47 -16.14 56.59 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -125.44 14.98 8.26 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.499 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.4 OUTLIER -71.64 137.7 48.1 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.952 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.182 0 C-N-CA 123.383 0.673 . . . . 0.0 112.259 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.749 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.5 mpt_? . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.808 0.337 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -99.56 119.83 38.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.602 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.9 tp -130.95 135.03 47.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.412 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.762 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -117.88 128.84 55.22 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.547 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.027 HD11 HG21 ' A' ' 30' ' ' ILE . 4.6 pt -147.77 178.65 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.505 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.8 t-105 -99.75 103.14 14.77 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -176.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.77 HD11 HG22 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -126.23 118.97 26.25 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 177.084 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 8' ' ' SER . . . . . 1.013 ' C ' HD23 ' B' ' 12' ' ' LEU . 0.3 OUTLIER -84.06 -161.49 0.55 Allowed 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.857 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ASP . . . . . 0.673 ' O ' HG22 ' B' ' 11' ' ' THR . 2.6 p-10 -61.53 -168.6 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.359 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLN . . . . . 0.517 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.9 tt0 37.65 41.59 0.32 Allowed 'General case' 0 C--N 1.345 0.373 0 C-N-CA 123.456 0.702 . . . . 0.0 112.771 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.673 HG22 ' O ' ' B' ' 9' ' ' ASP . 11.5 t 177.32 -51.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.83 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 1.013 HD23 ' C ' ' B' ' 8' ' ' SER . 0.5 OUTLIER -67.49 -30.46 70.16 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 176.32 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.417 ' HG2' ' HG ' ' B' ' 12' ' ' LEU . 2.1 mm-40 -91.85 -38.64 12.21 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.424 177.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.655 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.1 t70 -44.39 -27.04 0.39 Allowed 'General case' 0 C--N 1.342 0.259 0 CA-C-N 114.438 -1.256 . . . . 0.0 111.045 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.1 HD21 HD13 ' A' ' 34' ' ' LEU . 33.2 mt -70.75 25.2 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 31.9 mt-10 -101.64 -55.75 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -75.18 -23.38 57.69 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.355 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.902 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 19.2 mtm -87.14 -22.28 25.44 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.102 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.761 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.72 -66.42 0.92 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.252 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.9 mtt-85 -58.13 -65.1 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.978 0.418 . . . . 0.0 111.854 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.11 -33.26 18.15 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.275 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.514 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.6 mm-40 -87.39 -9.41 54.84 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.423 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.14 -8.26 77.36 Favored Glycine 0 C--N 1.339 0.696 0 C-N-CA 120.705 -0.759 . . . . 0.0 111.762 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.761 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 78.1 mt -72.14 174.89 6.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.541 0.686 . . . . 0.0 111.495 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.5 p -120.2 166.04 13.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.547 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.558 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -43.97 -39.45 4.07 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.362 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m -83.82 -53.08 5.87 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 121.996 0.119 . . . . 0.0 111.205 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.33 -7.37 6.18 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.716 0.294 . . . . 0.0 110.737 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.902 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.4 tpt -87.09 -48.56 7.98 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 122.632 1.206 . . . . 0.0 107.968 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.902 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -75.81 -36.75 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.08 0 CA-C-N 112.988 -1.915 . . . . 0.0 112.926 -177.81 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.43 -46.17 87.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.313 1.054 . . . . 0.0 108.585 177.129 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.42 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -60.07 -44.68 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 CA-C-N 112.919 -1.946 . . . . 0.0 110.759 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.709 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -51.11 -39.48 56.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.352 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.95 HD13 HD21 ' A' ' 15' ' ' LEU . 12.9 mt -73.28 -30.34 63.35 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.318 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -76.5 -19.47 57.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -129.73 20.44 5.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.686 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -72.8 134.11 44.78 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.727 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 2.3 mmpt? . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.453 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.84 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.783 0.325 . . . . 0.0 111.479 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.53 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 98.1 m95 -70.85 163.96 26.28 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.635 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.9 tp -163.74 142.99 8.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.501 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.794 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -123.79 134.59 53.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.699 178.954 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.765 HD11 HG21 ' B' ' 30' ' ' ILE . 1.8 pt -150.05 179.3 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.45 ' C ' HD22 ' A' ' 7' ' ' LEU . 76.9 t-105 -95.9 92.66 6.62 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.19 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.887 HD11 HG22 ' B' ' 30' ' ' ILE . 1.5 mm? -122.91 114.61 20.68 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.755 ' O ' HD23 ' A' ' 12' ' ' LEU . 27.0 p -72.68 -179.58 3.14 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.421 0.629 . . . . 0.0 110.27 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.489 ' O ' HG22 ' A' ' 11' ' ' THR . 3.8 p-10 -60.55 -160.48 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.379 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.523 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.87 43.27 0.27 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 123.634 0.773 . . . . 0.0 113.006 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.698 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t 177.44 -50.28 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.64 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.89 HD21 ' HD2' ' B' ' 1' ' ' ARG . 0.7 OUTLIER -70.84 -30.79 67.3 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.931 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -89.24 -37.93 14.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.566 -1.652 . . . . 0.0 107.936 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.698 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -50.61 -17.42 0.51 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.335 -1.302 . . . . 0.0 111.156 178.639 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.012 HD21 HD13 ' B' ' 34' ' ' LEU . 49.1 mt -69.04 25.75 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 179.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -97.94 -54.27 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.608 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -71.32 -21.47 62.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.282 179.144 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.952 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 8.6 mtm -90.77 -23.05 20.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.709 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.723 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -101.13 -64.77 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.545 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 -54.12 -67.18 0.28 Allowed 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.608 ' HG3' ' HE3' ' A' ' 17' ' ' LYS . 13.6 mmp_? -51.22 -29.13 13.32 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.422 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 18' ' ' MET . 20.7 mm-40 -89.91 -8.24 52.3 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.255 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.82 -6.88 76.7 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 120.69 -0.766 . . . . 0.0 111.721 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.723 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.9 mt -74.67 173.79 9.99 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.582 0.706 . . . . 0.0 111.485 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.5 p -117.57 168.18 10.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.455 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.553 ' NZ ' HD11 ' B' ' 3' ' ' LEU . 4.5 mmmm -46.39 -39.77 10.97 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.63 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 2.3 m -84.56 -52.34 6.2 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.132 0.173 . . . . 0.0 111.408 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.442 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.3 mm-40 -62.55 -7.28 4.39 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.7 0.286 . . . . 0.0 110.738 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.952 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.8 tpt -87.1 -48.5 8.03 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 122.657 1.218 . . . . 0.0 107.97 177.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.118 HG21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -76.12 -37.94 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.981 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.911 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.51 HD21 HG21 ' B' ' 11' ' ' THR . 0.2 OUTLIER -62.92 -45.22 93.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 122.335 1.064 . . . . 0.0 108.604 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -62.23 -42.9 97.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 112.85 -1.977 . . . . 0.0 111.328 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.723 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.39 -35.39 28.04 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.521 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.027 HD13 HD21 ' B' ' 15' ' ' LEU . 15.3 mt -76.45 -31.11 57.65 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.35 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -77.68 -16.49 58.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -126.57 16.85 7.56 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.512 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.3 OUTLIER -70.51 137.75 50.46 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.128 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.848 -1.072 . . . . 0.0 112.265 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.89 ' HD2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 120.829 0.347 . . . . 0.0 111.487 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.83 156.66 39.05 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.015 0.436 . . . . 0.0 110.065 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.553 HD11 ' NZ ' ' A' ' 26' ' ' LYS . 4.8 tp -159.38 139.23 11.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.157 -178.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.794 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -122.8 133.94 54.43 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.218 179.439 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.118 HD12 HG21 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -154.79 -176.8 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.699 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.768 ' O ' HD13 ' B' ' 7' ' ' LEU . 70.6 t-105 -92.51 88.2 6.26 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 1.033 HD11 HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -127.33 96.62 4.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.84 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 31.0 p -65.94 179.93 0.82 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.882 0.849 . . . . 0.0 112.806 -177.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -50.62 -54.14 25.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.337 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -49.82 -26.14 3.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.583 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 25.3 p -90.97 -28.85 17.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' B' ' 8' ' ' SER . 21.1 mt -76.24 -39.35 54.72 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -60.21 -41.03 92.14 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 113.643 -1.617 . . . . 0.0 107.229 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.606 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -53.94 -40.2 66.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.906 178.231 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.027 HD21 HD13 ' A' ' 34' ' ' LEU . 39.2 mt -77.01 29.41 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.41 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 40.6 mt-10 -99.5 -61.18 1.4 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -74.34 -22.99 58.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.439 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.729 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.9 mtm -85.65 -21.61 28.32 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.845 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.91 -67.5 0.84 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.055 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.41 ' HE ' ' HA ' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -55.81 -63.04 1.3 Allowed 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.969 0.414 . . . . 0.0 111.558 -179.152 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.22 -33.95 9.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.513 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 18' ' ' MET . 13.7 mm-40 -76.22 -28.96 57.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.571 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 102.88 -12.41 56.2 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 121.201 -0.523 . . . . 0.0 113.012 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.845 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -87.86 -174.51 4.76 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -179.341 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.0 p -105.02 167.28 9.81 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.93 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' B' ' 29' ' ' MET . 0.4 OUTLIER -49.8 -37.8 31.7 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.469 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.45 ' O ' HD11 ' A' ' 7' ' ' LEU . 4.3 m -79.03 -55.88 4.8 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.411 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.9 mt-10 -56.36 -20.12 17.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.729 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.6 tpt -70.87 -46.68 62.21 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 122.61 1.195 . . . . 0.0 108.68 177.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.887 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -75.57 -31.55 23.47 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.298 0 CA-C-N 113.047 -1.888 . . . . 0.0 113.254 -177.0 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.533 ' OD1' HG21 ' A' ' 11' ' ' THR . 0.0 OUTLIER -65.78 -46.47 78.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 122.397 1.094 . . . . 0.0 108.339 176.318 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.408 ' N ' HD22 ' B' ' 31' ' ' ASN . 1.6 t -58.36 -44.69 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-N 112.711 -2.04 . . . . 0.0 111.142 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.73 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -51.08 -32.18 21.41 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.63 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.012 HD13 HD21 ' A' ' 15' ' ' LEU . 18.6 mt -79.2 -31.39 43.77 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.857 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -78.8 -16.3 57.32 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.0 m80 -124.99 16.88 8.53 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.487 ' CE1' ' HB2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -69.96 138.93 52.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.119 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.487 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.171 0 CA-C-O 118.83 -0.605 . . . . 0.0 111.902 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -98.57 105.63 17.8 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tp -125.54 139.25 53.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.712 -178.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 6.5 m -96.0 139.51 32.08 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.04 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 1.08 HD13 HG21 ' B' ' 30' ' ' ILE . 1.1 pp -152.12 174.06 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.125 0.488 . . . . 0.0 112.227 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.769 ' O ' HD13 ' A' ' 7' ' ' LEU . 70.8 t-105 -90.34 106.76 18.71 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -176.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.04 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -133.15 115.65 15.31 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.446 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.559 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.6 p -89.37 -173.77 4.13 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.494 0.664 . . . . 0.0 111.875 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -49.65 -58.01 6.1 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.025 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -50.86 -27.28 7.09 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.61 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 28.1 p -91.83 -31.23 15.8 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.205 0.816 . . . . 0.0 113.205 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 8' ' ' SER . 46.1 mt -72.17 -40.55 67.88 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.49 -41.2 98.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.079 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.61 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.16 -44.88 61.55 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.404 178.949 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.101 HD22 ' CG ' ' A' ' 29' ' ' MET . 22.9 mt -79.41 24.87 0.33 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -104.47 -58.81 1.83 Allowed 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -73.86 -32.03 63.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.425 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.561 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 43.1 mtm -74.09 -61.72 1.75 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.224 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.845 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -51.8 -48.38 63.87 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 -58.87 -66.68 0.46 Allowed 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 121.031 0.443 . . . . 0.0 111.218 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.55 -32.11 17.57 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.572 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 18' ' ' MET . 13.8 mm-40 -75.59 -26.12 57.61 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.815 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.19 13.44 80.82 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.949 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.845 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -110.32 177.56 4.66 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 111.854 -179.828 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.3 p -104.03 165.68 10.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.723 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.478 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 6.9 mttm -40.74 -41.39 1.53 Allowed 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.582 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 85.3 p -73.43 -59.3 2.78 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.326 0.108 . . . . 0.0 111.022 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.549 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 1.8 mm-40 -57.21 -22.07 38.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.176 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' MET . . . . . 1.101 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -71.67 -48.43 47.61 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.891 1.329 . . . . 0.0 108.751 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.903 HG21 HD13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -76.32 -31.74 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.266 0 CA-C-N 112.713 -2.039 . . . . 0.0 114.185 -176.588 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.443 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -70.17 -47.29 62.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 122.155 0.979 . . . . 0.0 109.797 178.383 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.549 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -65.02 -39.14 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-N 113.309 -1.768 . . . . 0.0 111.122 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.705 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -42.87 -61.56 1.24 Allowed 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.419 -1.264 . . . . 0.0 112.169 -179.281 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.864 ' HB3' ' HB2' ' B' ' 33' ' ' ALA . 0.0 OUTLIER -75.07 -28.69 60.45 Favored 'General case' 0 N--CA 1.432 -1.37 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.636 -177.019 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.858 ' N ' HD22 ' A' ' 34' ' ' LEU . 8.1 mt-30 -58.17 -20.22 39.18 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.333 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -120.41 25.09 10.02 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.2 0.524 . . . . 0.0 109.683 175.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.695 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -91.5 141.21 28.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.153 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.152 0 C-N-CA 123.471 0.708 . . . . 0.0 112.16 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 2.1 mpt_? . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.858 0.361 . . . . 0.0 111.679 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -109.98 109.27 19.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.475 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.4 tp -134.46 144.25 48.0 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.205 -178.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -96.46 137.1 36.04 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.903 HD13 HG21 ' A' ' 30' ' ' ILE . 4.4 pt -137.41 170.84 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.582 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 75.1 t-105 -100.31 106.81 18.47 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -177.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.784 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.7 OUTLIER -126.85 114.64 18.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.921 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.585 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 14.3 p -83.04 178.11 8.29 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.814 0.816 . . . . 0.0 112.13 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -51.7 -50.73 59.89 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.921 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -45.46 -35.68 3.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.474 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.819 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -104.7 -14.22 15.65 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' B' ' 8' ' ' SER . 94.1 mt -65.07 -39.25 92.97 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.13 -43.93 93.76 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 113.496 -1.684 . . . . 0.0 107.98 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.819 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -52.67 -40.29 62.74 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.545 178.839 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.743 HD22 ' CG ' ' B' ' 29' ' ' MET . 14.6 mt -77.95 28.96 0.17 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -104.16 -61.54 1.43 Allowed 'General case' 0 N--CA 1.461 0.11 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.51 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 16.6 mtpp -71.87 -21.74 61.61 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.345 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.795 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 25.7 mtm -90.22 -24.72 20.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.399 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.702 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -104.16 -64.38 1.11 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.515 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 10.7 mtp-105 -60.16 -65.74 0.63 Allowed 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 120.998 0.428 . . . . 0.0 111.69 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ARG . . . . . 0.51 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -50.6 -33.43 22.06 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.421 179.826 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' B' ' 18' ' ' MET . 16.1 mm-40 -84.84 -11.18 56.22 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.174 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.08 -5.67 84.74 Favored Glycine 0 C--N 1.339 0.737 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.856 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.886 HD22 ' HB3' ' B' ' 28' ' ' GLU . 72.4 mt -75.49 175.58 8.36 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.568 0.699 . . . . 0.0 111.295 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 10.6 p -119.76 174.5 6.39 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.652 -1.158 . . . . 0.0 108.8 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.486 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.0 mttm -51.14 -29.54 13.84 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 111.687 0.254 . . . . 0.0 111.687 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.636 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 34.5 m -82.51 -60.58 2.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.529 0.332 . . . . 0.0 111.496 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.886 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.6 mt-10 -61.03 -9.19 4.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.221 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.795 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.9 tpt -86.58 -46.62 9.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 1.08 HG21 HD13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -75.22 -32.89 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 CA-C-N 113.042 -1.89 . . . . 0.0 113.282 -178.186 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.487 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -70.78 -50.37 36.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 122.119 0.961 . . . . 0.0 109.203 177.776 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.487 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -54.79 -40.31 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 CA-C-N 113.212 -1.813 . . . . 0.0 109.844 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.864 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . . . -44.44 -43.69 7.94 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.894 -1.503 . . . . 0.0 111.242 178.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.908 HD13 HD21 ' A' ' 15' ' ' LEU . 9.4 mt -78.54 -29.25 46.29 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.148 -177.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -70.66 -25.43 63.0 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -133.4 21.65 4.0 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.575 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -64.58 140.21 58.84 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 177.778 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.479 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.661 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.997 ' HD3' HD21 ' B' ' 12' ' ' LEU . 1.5 ttt-85 . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.35 118.57 25.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.545 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 mm? -131.46 148.92 52.69 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.436 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.869 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -117.04 128.6 55.32 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.436 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.673 ' CD1' HG21 ' B' ' 30' ' ' ILE . 2.4 pp -154.92 172.41 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.774 0.321 . . . . 0.0 111.387 -178.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.613 ' O ' ' HB2' ' B' ' 27' ' ' SER . 57.9 t-105 -79.56 78.21 6.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.553 0.692 . . . . 0.0 111.088 -179.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.026 HD11 HG21 ' A' ' 11' ' ' THR . 54.2 tp -115.54 76.14 0.99 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.755 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 24.3 p -76.1 -145.04 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.475 -177.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.13 -155.28 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.245 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.53 44.43 0.11 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.323 0.649 . . . . 0.0 112.299 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . 1.026 HG21 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -178.5 -50.34 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.432 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.563 HD21 HD22 ' B' ' 3' ' ' LEU . 19.1 mt -70.17 -41.09 74.23 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 175.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -79.09 -39.78 32.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.037 -1.892 . . . . 0.0 108.323 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.759 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -50.6 -29.08 10.01 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.796 178.623 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.281 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -77.38 31.8 0.15 Allowed 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.217 1.007 . . . . 0.0 112.929 179.71 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -76.61 -59.81 2.61 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -96.71 13.13 29.45 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.706 ' HB2' HD13 ' A' ' 15' ' ' LEU . 8.5 mtm -102.08 -76.68 0.57 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.09 0.405 . . . . 0.0 111.271 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.904 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -26.39 -32.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 126.507 1.923 . . . . 0.0 114.377 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 31.4 mmm-85 -66.92 -122.72 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.344 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -53.21 -21.94 5.96 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 121.973 -0.454 . . . . 0.0 111.881 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -113.53 -1.55 14.08 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 115.594 1.701 . . . . 0.0 115.594 -176.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.835 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -143.87 14.09 2.17 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 116.197 -2.906 . . . . 0.0 116.852 -176.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.539 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.1 mp 53.34 -161.52 0.12 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 119.312 1.556 . . . . 0.0 112.953 176.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -65.09 167.57 7.82 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.171 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -43.05 64.19 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' B' ' 6' ' ' TRP . 23.7 p -83.81 -47.52 11.03 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.892 -0.14 . . . . 0.0 111.086 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -56.04 -30.5 62.0 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' MET . . . . . 1.281 ' SD ' HD11 ' A' ' 15' ' ' LEU . 4.7 tpt -59.83 -47.83 84.12 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 122.69 1.233 . . . . 0.0 109.952 177.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.105 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -79.34 -27.09 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.508 0 CA-C-N 112.828 -1.987 . . . . 0.0 114.099 -175.471 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 1.001 HD21 HG21 ' B' ' 11' ' ' THR . 0.2 OUTLIER -70.62 -48.68 53.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 122.286 1.041 . . . . 0.0 108.82 176.664 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.7 t -60.17 -46.19 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-N 112.986 -1.916 . . . . 0.0 111.553 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.877 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -45.54 -40.6 8.84 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.236 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.97 HD21 ' HB2' ' B' ' 33' ' ' ALA . 11.4 mt -80.5 -28.8 37.39 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.245 -177.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -71.91 -13.94 61.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.509 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.6 m80 -129.83 46.25 2.68 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.572 0.225 . . . . 0.0 111.153 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.742 ' HA ' ' CD2' ' B' ' 36' ' ' HIS . 0.8 OUTLIER -60.46 132.12 52.89 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.312 0.577 . . . . 0.0 112.025 179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.633 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.9 mmmt . . . . . 0 C--O 1.249 1.066 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.889 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.755 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 121.028 0.442 . . . . 0.0 111.806 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.4 173.6 4.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.191 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.948 ' CD2' HD23 ' A' ' 7' ' ' LEU . 2.1 tp -173.4 150.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.738 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.869 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.9 OUTLIER -129.47 130.66 46.15 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.463 178.689 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.872 ' CD1' HG21 ' A' ' 30' ' ' ILE . 5.4 pt -144.47 176.66 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.499 ' C ' HD22 ' B' ' 7' ' ' LEU . 76.4 t-105 -103.05 98.4 8.35 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 1.105 HD11 HG22 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -125.55 126.98 45.68 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 175.742 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.509 ' O ' HD23 ' B' ' 12' ' ' LEU . 2.3 t -81.87 -150.46 0.08 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.141 -0.624 . . . . 0.0 109.496 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ASP . . . . . 0.432 ' O ' HG22 ' B' ' 11' ' ' THR . 0.7 OUTLIER -87.56 -163.56 0.96 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.783 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 10' ' ' GLN . . . . . 0.443 ' O ' ' HB ' ' B' ' 11' ' ' THR . 2.2 tt0 35.77 39.14 0.06 Allowed 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.448 0.699 . . . . 0.0 112.309 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' THR . . . . . 1.001 HG21 HD21 ' A' ' 31' ' ' ASN . 1.9 t -176.57 -52.36 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.671 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.997 HD21 ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -67.93 -33.15 74.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.266 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.579 ' N ' HD12 ' B' ' 12' ' ' LEU . 29.6 mt-10 -96.41 -37.64 10.37 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.062 -1.426 . . . . 0.0 109.271 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.682 ' HB2' ' N ' ' B' ' 11' ' ' THR . 1.5 m-20 -56.7 -34.54 67.53 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.666 -178.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.925 HD12 ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.58 -5.02 30.28 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.881 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.504 ' N ' HD22 ' B' ' 15' ' ' LEU . 10.9 mm-40 -60.11 -46.95 87.91 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.334 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -55.56 -35.59 65.9 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.101 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.518 ' CE ' ' HB2' ' B' ' 15' ' ' LEU . 34.8 mtm -69.57 -59.8 2.73 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.105 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.763 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -36.41 -46.88 0.58 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.485 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 1.5 mmm-85 -67.7 -73.73 0.13 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -50.86 -29.99 13.32 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.59 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.478 ' HG3' ' HB3' ' B' ' 18' ' ' MET . 25.0 mm-40 -79.29 -27.65 42.24 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.688 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 0.475 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 94.58 67.17 1.02 Allowed Glycine 0 C--N 1.341 0.83 0 C-N-CA 120.263 -0.97 . . . . 0.0 113.587 178.553 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.763 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 177.86 -176.74 0.19 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.099 0.476 . . . . 0.0 111.554 178.038 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 25' ' ' SER . . . . . 0.472 ' N ' HD23 ' B' ' 24' ' ' LEU . 3.5 t -115.79 176.4 5.1 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.125 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.467 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.9 mttm -41.44 -39.53 1.53 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.613 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 26.6 p -73.3 -63.77 1.12 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.674 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.8 mm-40 -59.19 -18.6 37.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.799 ' HG2' ' CD2' ' B' ' 15' ' ' LEU . 1.1 tpt -74.55 -48.08 28.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 123.793 1.758 . . . . 0.0 107.494 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.916 HG22 HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.79 -23.26 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.82 0 CA-C-N 112.79 -2.005 . . . . 0.0 112.062 -178.907 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -85.17 -44.74 12.68 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.741 176.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.771 ' CG2' ' HE3' ' B' ' 29' ' ' MET . 4.4 m -52.39 -34.59 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-O 121.969 0.89 . . . . 0.0 109.211 178.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.97 ' HB2' HD21 ' A' ' 34' ' ' LEU . . . -37.72 -45.33 0.79 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.065 -1.879 . . . . 0.0 111.734 178.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.87 HD13 ' CD2' ' A' ' 15' ' ' LEU . 8.5 mt -83.01 -32.29 27.0 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.638 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -73.89 -21.18 60.18 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.922 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 8.0 p-80 -105.71 -27.84 11.07 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.653 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 12.5 t80 -52.06 149.21 5.33 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.003 0.365 . . . . 0.0 110.067 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.577 ' HD3' ' CE2' ' B' ' 37' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 123.342 0.657 . . . . 0.0 112.455 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.748 ' HD2' ' CD2' ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.727 0.299 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -70.91 128.5 36.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 110.301 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 5' ' ' ILE . 2.3 tp -123.93 135.75 53.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.609 -178.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.768 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -131.84 123.55 27.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.156 179.33 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.869 HD11 HD21 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -152.64 -173.79 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.096 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.617 ' C ' HD22 ' A' ' 7' ' ' LEU . 68.8 t-105 -91.82 92.21 8.28 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -177.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.019 HD11 HG22 ' B' ' 30' ' ' ILE . 2.0 mm? -129.56 103.37 6.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.642 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 28.4 p -66.3 -142.71 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 120.87 0.367 . . . . 0.0 111.515 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -97.46 -147.4 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.065 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.504 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.8 tt0 32.42 45.75 0.06 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.483 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.821 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.6 OUTLIER -172.53 -51.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.694 179.166 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.543 HD13 HD13 ' B' ' 3' ' ' LEU . 17.1 mt -72.19 -41.47 66.92 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -81.15 -38.79 26.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.59 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.821 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -42.83 -28.52 0.25 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-N 114.538 -1.21 . . . . 0.0 111.081 179.209 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.847 ' CD2' HD23 ' B' ' 34' ' ' LEU . 0.1 OUTLIER -65.24 9.0 0.12 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -53.56 -41.03 66.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -87.26 -24.63 24.3 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.75 ' HB2' HD12 ' A' ' 15' ' ' LEU . 4.1 mtm -97.75 -65.85 0.94 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.882 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -33.9 -31.38 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -64.99 -108.22 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 119.524 -0.87 . . . . 0.0 110.743 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -24.35 59.06 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -107.42 -21.59 12.87 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.882 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -128.52 21.27 5.42 Favored Glycine 0 CA--C 1.507 -0.46 0 C-N-CA 117.17 -2.443 . . . . 0.0 116.831 -176.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.706 HD12 ' C ' ' A' ' 23' ' ' GLY . 0.9 OUTLIER 51.0 -157.71 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 118.909 1.354 . . . . 0.0 113.192 175.223 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.461 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.1 p -62.51 159.34 15.91 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.341 -1.3 . . . . 0.0 109.468 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.46 -42.31 6.97 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.7 p -80.88 -40.97 23.87 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.686 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mm-40 -61.82 -28.39 69.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.125 -0.23 . . . . 0.0 110.757 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.841 ' SD ' HD21 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -67.11 -42.38 84.62 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-O 122.512 1.148 . . . . 0.0 108.567 177.586 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.653 HG22 ' CD1' ' B' ' 7' ' ' LEU . 0.3 OUTLIER -76.77 -35.04 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.365 0 CA-C-N 112.725 -2.034 . . . . 0.0 113.473 -175.474 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.443 HD21 HG21 ' B' ' 11' ' ' THR . 0.1 OUTLIER -63.97 -46.85 82.83 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -58.7 -41.27 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 CA-C-N 112.635 -2.075 . . . . 0.0 111.425 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.998 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -45.42 -41.16 8.95 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.696 -1.138 . . . . 0.0 112.119 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.887 HD22 HD21 ' B' ' 15' ' ' LEU . 7.0 mt -81.47 -29.87 33.57 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.961 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -71.67 -17.51 62.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 33.2 m80 -118.23 39.61 3.38 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.609 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 58.1 t80 -90.01 162.81 15.19 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.374 -178.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.557 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.271 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.642 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.978 0.418 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -75.82 138.45 41.16 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.963 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.543 HD13 HD13 ' A' ' 12' ' ' LEU . 2.2 tp -128.33 133.13 48.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.469 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.768 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -126.19 123.78 38.99 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.776 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.86 HG13 HD21 ' B' ' 7' ' ' LEU . 1.6 pt -154.29 175.69 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.441 ' O ' HD13 ' B' ' 7' ' ' LEU . 75.3 t-105 -88.57 96.13 10.51 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.86 HD21 HG13 ' B' ' 5' ' ' ILE . 1.1 mm? -119.5 118.93 32.39 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.734 ' O ' HD23 ' B' ' 12' ' ' LEU . 44.9 p -65.7 164.97 13.41 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.995 0.903 . . . . 0.0 111.165 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ASP . . . . . 0.441 ' HA ' ' CD2' ' B' ' 12' ' ' LEU . 8.3 t70 -64.45 -37.9 89.16 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 113.633 -1.621 . . . . 0.0 112.924 -177.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -73.16 38.75 0.09 Allowed 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.806 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 7.9 t -174.17 -51.54 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.975 0.51 . . . . 0.0 111.877 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.748 ' CD2' ' HD2' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -57.54 -28.61 63.68 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 176.674 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 68.7 mm-40 -84.23 -38.9 19.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.393 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.806 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.2 t70 -44.14 -29.58 0.64 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.829 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.887 HD21 HD22 ' A' ' 34' ' ' LEU . 28.9 mt -79.4 27.07 0.27 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.425 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.1 OUTLIER -111.46 -52.18 2.8 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.247 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -76.93 -32.68 57.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 120.835 0.35 . . . . 0.0 110.597 178.812 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.467 ' HE3' ' CG ' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -97.25 20.64 11.14 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.111 179.32 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.91 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -100.03 -19.79 16.36 Favored 'General case' 0 C--O 1.214 -0.779 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.431 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 39.1 mmm-85 -65.67 -126.35 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.726 0 O-C-N 121.657 -0.652 . . . . 0.0 110.468 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -52.69 -22.85 5.64 Favored 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 121.681 -0.637 . . . . 0.0 110.439 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -93.64 -23.43 18.27 Favored 'General case' 0 CA--C 1.522 -0.127 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 0.91 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -134.99 16.28 4.22 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 117.19 -2.433 . . . . 0.0 116.369 -177.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.733 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.0 OUTLIER 55.56 -166.18 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.653 1.226 . . . . 0.0 113.667 175.846 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.1 m -53.94 149.56 8.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.145 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -41.8 -46.44 3.9 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.621 ' O ' HD11 ' A' ' 7' ' ' LEU . 74.5 p -75.87 -44.13 42.19 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.652 0.263 . . . . 0.0 110.702 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.653 ' O ' HG22 ' B' ' 32' ' ' VAL . 3.6 mt-10 -54.78 -38.68 67.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.74 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.865 ' HE3' HG23 ' B' ' 32' ' ' VAL . 4.0 tpt -57.89 -47.21 83.45 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 123.623 1.678 . . . . 0.0 108.935 177.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 1.019 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -65.9 -21.45 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.667 0 CA-C-N 112.972 -1.922 . . . . 0.0 112.649 -178.099 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.582 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -83.53 -46.36 12.52 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 177.49 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.865 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -58.66 -30.3 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.062 0 CA-C-O 121.878 0.847 . . . . 0.0 109.009 177.833 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 1.001 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.15 -54.71 1.73 Allowed 'General case' 0 CA--C 1.495 -1.14 0 CA-C-N 113.599 -1.637 . . . . 0.0 108.729 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.103 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -67.44 -46.72 72.26 Favored 'General case' 0 N--CA 1.399 -2.976 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.243 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 35' ' ' GLN . . . . . 1.103 ' N ' HD13 ' B' ' 34' ' ' LEU . 27.0 mt-30 -64.21 -59.33 4.55 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 1.001 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.3 p80 -65.87 -16.41 63.81 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.728 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.8 OUTLIER -55.83 137.69 49.62 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.577 0.351 . . . . 0.0 110.298 178.682 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.474 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.067 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.82 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.775 0.322 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.482 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.5 m95 -78.95 165.76 23.12 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.427 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 tp -171.34 147.29 2.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.238 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.932 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -108.57 140.32 42.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.824 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.947 ' CD1' HG21 ' B' ' 30' ' ' ILE . 3.8 pt -147.92 176.64 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.715 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 76.6 t-105 -100.86 100.77 11.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.815 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.7 OUTLIER -131.18 114.62 15.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.77 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -88.54 -167.11 1.78 Allowed 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.422 0.63 . . . . 0.0 112.303 -178.209 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -50.85 -57.99 7.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.784 -1.098 . . . . 0.0 112.419 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.25 -29.55 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.623 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 69.8 p -95.26 -33.39 12.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 8' ' ' SER . 69.9 mt -67.94 -40.69 83.23 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 178.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -59.98 -43.91 94.81 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.749 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.623 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -57.06 -51.62 68.53 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.395 -1.275 . . . . 0.0 109.564 178.236 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.982 HD22 ' CG ' ' A' ' 29' ' ' MET . 14.8 mt -78.15 24.56 0.25 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.87 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.448 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -114.99 -52.96 2.67 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 178.454 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HG2' ' HG2' ' A' ' 16' ' ' GLU . 0.8 OUTLIER -87.49 -32.82 19.25 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 122.667 0.387 . . . . 0.0 110.782 178.522 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.752 ' HE1' ' HB2' ' B' ' 34' ' ' LEU . 0.5 OUTLIER -91.73 6.04 47.49 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.46 179.619 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.875 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -97.21 -15.53 20.81 Favored 'General case' 0 C--O 1.211 -0.928 0 C-N-CA 122.669 0.388 . . . . 0.0 111.737 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.429 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -68.35 -124.55 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.785 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 tpp85 -52.29 -25.13 8.7 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 118.606 0.639 . . . . 0.0 110.296 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -92.04 -20.05 21.72 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 114.498 1.295 . . . . 0.0 114.498 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.875 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -142.58 19.56 2.41 Favored Glycine 0 CA--C 1.504 -0.612 0 C-N-CA 116.64 -2.695 . . . . 0.0 116.564 -177.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.737 HD12 ' C ' ' A' ' 23' ' ' GLY . 0.9 OUTLIER 50.73 -161.52 0.07 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.879 1.339 . . . . 0.0 113.54 175.624 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.488 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.8 p -60.48 156.78 15.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.666 178.147 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.55 -40.15 2.56 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.447 ' OG ' HG22 ' B' ' 5' ' ' ILE . 29.3 m -79.68 -49.36 12.21 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.247 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.73 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.2 mm-40 -55.49 -30.41 60.57 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.387 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.982 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -61.01 -50.84 71.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.069 1.414 . . . . 0.0 108.767 177.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.011 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -71.81 -34.66 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.523 0 CA-C-N 112.929 -1.941 . . . . 0.0 114.133 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.25 -47.98 72.0 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.872 0.844 . . . . 0.0 109.092 177.284 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.534 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.12 -39.43 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-N 113.684 -1.598 . . . . 0.0 111.445 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.577 ' O ' ' HB1' ' B' ' 33' ' ' ALA . . . -47.56 -40.37 18.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.063 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.004 HD13 ' CD2' ' B' ' 15' ' ' LEU . 11.9 mt -78.51 -28.47 46.25 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.364 -177.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -77.23 -18.83 57.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.6 m80 -104.75 -38.79 6.56 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.539 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 24.6 t80 -44.32 153.6 0.15 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.954 0.407 . . . . 0.0 111.966 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.522 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 9.3 mmmt . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.493 -0.765 . . . . 0.0 111.364 177.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.77 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.2 mpt_? . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.194 0.521 . . . . 0.0 111.861 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 74.4 m95 -114.66 105.04 12.59 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.468 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 1.5 tp -126.49 146.57 50.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.819 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.932 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -106.01 136.73 45.15 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.921 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.011 HD12 HG21 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -148.41 -177.57 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.403 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.666 ' O ' HD13 ' B' ' 7' ' ' LEU . 65.7 t-105 -92.28 90.13 7.14 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.907 HD11 HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -127.01 94.41 4.02 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.82 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 42.6 p -64.58 177.54 0.89 Allowed 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.79 0.805 . . . . 0.0 112.342 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -52.87 -50.07 64.54 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.196 -1.365 . . . . 0.0 111.67 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.0 -26.55 6.18 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.642 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 26.1 p -92.45 -25.65 18.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.455 HD11 ' HE ' ' A' ' 1' ' ' ARG . 22.7 mt -77.88 -40.71 39.12 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.72 -40.95 89.7 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 113.957 -1.474 . . . . 0.0 107.233 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.548 ' O ' ' HG3' ' B' ' 18' ' ' MET . 41.8 t0 -54.82 -39.22 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 114.016 -1.447 . . . . 0.0 110.276 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.004 ' CD2' HD13 ' A' ' 34' ' ' LEU . 32.1 mt -76.96 27.72 0.14 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.486 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 47.4 mt-10 -99.82 -54.46 2.9 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -77.48 -22.0 51.97 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.51 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.895 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 11.3 mtm -91.29 -24.21 19.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.944 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.713 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.32 -66.51 0.91 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.486 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -54.7 -67.82 0.24 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -179.419 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -31.44 11.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.405 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.504 ' HB2' ' O ' ' B' ' 18' ' ' MET . 15.9 mm-40 -87.95 -9.94 52.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.261 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.26 -3.39 86.25 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.855 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.713 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 87.3 mt -75.74 172.65 12.28 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.532 0.682 . . . . 0.0 111.6 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.4 p -115.47 163.4 15.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 mttm -42.16 -41.56 2.71 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.715 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 4.3 m -84.77 -50.5 7.53 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.626 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.5 mt-10 -64.49 -7.98 12.07 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.732 0.301 . . . . 0.0 110.245 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.947 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.0 tpt -85.37 -47.15 10.27 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 122.639 1.209 . . . . 0.0 108.028 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.947 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.4 OUTLIER -75.86 -40.96 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 112.971 -1.922 . . . . 0.0 113.141 -177.436 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -44.76 95.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.972 0.891 . . . . 0.0 109.658 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.626 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -70.49 -32.86 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 113.714 -1.585 . . . . 0.0 112.545 -179.208 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.729 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -54.7 -53.14 58.87 Favored 'General case' 0 CA--C 1.501 -0.916 0 CA-C-O 121.889 0.852 . . . . 0.0 110.163 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.934 HD22 HD21 ' A' ' 15' ' ' LEU . 4.0 pp -72.27 -25.52 61.63 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.744 -1.571 . . . . 0.0 112.033 -178.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' GLN . . . . . 0.713 ' N ' HD12 ' B' ' 34' ' ' LEU . 0.9 OUTLIER -66.94 -19.75 65.78 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.389 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 55.0 m80 -116.27 24.37 11.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 175.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -95.87 143.96 26.63 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.323 0.649 . . . . 0.0 110.124 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.499 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.724 -0.655 . . . . 0.0 112.225 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.776 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.071 0.462 . . . . 0.0 111.881 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -112.3 111.04 21.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.263 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -127.3 144.08 51.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.362 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.825 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -109.9 136.65 48.86 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.434 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.797 ' CD1' HD21 ' A' ' 7' ' ' LEU . 1.8 pt -150.08 176.82 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.465 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.3 t-105 -93.61 90.91 6.82 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -177.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.797 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.8 OUTLIER -124.64 104.14 8.52 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.558 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 6.9 t -78.77 -139.1 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -80.59 -160.09 0.28 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.258 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.41 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.9 tt0 35.07 45.07 0.16 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-O 121.538 0.685 . . . . 0.0 111.667 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.782 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.65 -52.33 0.02 OUTLIER 'General case' 0 C--O 1.23 0.079 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.893 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.576 HD11 ' O ' ' A' ' 7' ' ' LEU . 18.1 mt -73.93 -42.09 61.11 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.303 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -76.44 -39.37 53.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 113.125 -1.852 . . . . 0.0 108.207 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.782 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -45.16 -38.69 5.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.302 178.896 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.907 HD12 ' HB2' ' A' ' 19' ' ' ALA . 3.0 mm? -68.68 7.01 0.72 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -62.42 -39.81 94.51 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -102.09 -10.85 19.32 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.727 ' HB2' HD13 ' A' ' 15' ' ' LEU . 29.4 mtm -97.91 -66.11 0.92 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.913 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -36.87 -29.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 20.8 mmm-85 -64.69 -109.76 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.437 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -25.07 64.53 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.676 0.274 . . . . 0.0 111.692 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 18' ' ' MET . 22.8 mm-40 -105.48 -11.13 16.54 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -177.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.913 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -138.97 17.66 3.19 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 116.553 -2.737 . . . . 0.0 116.63 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.694 HD12 ' C ' ' A' ' 23' ' ' GLY . 0.8 OUTLIER 49.91 -157.61 0.09 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 119.054 1.427 . . . . 0.0 112.739 175.56 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -61.14 160.27 10.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.269 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.22 -39.29 13.79 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.679 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 69.5 m -79.04 -44.55 21.96 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.72 0.266 . . . . 0.0 111.72 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 9.8 mm-40 -61.72 -31.31 71.47 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.907 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.723 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.26 -38.8 92.34 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.771 1.272 . . . . 0.0 107.77 177.029 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.088 HG21 HD12 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -76.18 -17.98 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.97 0 CA-C-N 112.744 -2.025 . . . . 0.0 113.569 -176.915 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.532 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -73.18 -51.97 15.86 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.115 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.532 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 7.3 p -65.95 -28.46 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.441 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.798 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -41.97 -42.44 2.81 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.811 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.855 HD21 HD13 ' B' ' 30' ' ' ILE . 9.0 mt -84.49 -27.7 27.25 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.157 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.428 ' HB2' ' HA ' ' A' ' 32' ' ' VAL . 31.2 mt-30 -63.53 -32.58 74.08 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.798 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 14.0 p-80 -97.91 -38.11 9.54 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.339 0.518 . . . . 0.0 112.178 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.563 ' CG ' ' HA ' ' B' ' 33' ' ' ALA . 21.4 t80 -45.87 141.18 3.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.129 0 C-N-CA 123.678 0.791 . . . . 0.0 112.269 178.261 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.558 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 120.725 0.298 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -100.28 114.16 27.42 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 tp -133.07 145.4 50.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.643 -178.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.825 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -111.6 136.34 50.94 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.992 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.088 HD12 HG21 ' A' ' 30' ' ' ILE . 1.5 pt -147.04 -176.89 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.718 ' O ' HD13 ' B' ' 7' ' ' LEU . 71.0 t-105 -98.69 98.49 9.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.984 HD11 HG23 ' A' ' 30' ' ' ILE . 0.8 OUTLIER -131.14 108.8 9.99 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.575 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.776 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -92.52 -164.96 1.25 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.436 0.636 . . . . 0.0 112.053 -178.225 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -45.15 -62.57 1.2 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.513 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -50.79 -29.75 12.39 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.567 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 68.6 p -88.46 -34.74 17.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' B' ' 8' ' ' SER . 45.0 mt -69.95 -40.01 75.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -61.95 -41.92 98.53 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.783 -1.553 . . . . 0.0 107.736 175.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.567 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.4 OUTLIER -53.35 -49.43 67.15 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.003 178.516 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.891 HD22 ' CG ' ' B' ' 29' ' ' MET . 17.9 mt -73.76 8.38 1.97 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.74 -40.1 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.72 -26.59 29.62 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.822 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.0 mtm -86.23 -64.43 1.15 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.752 -0.204 . . . . 0.0 111.4 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.582 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -47.89 -43.94 29.12 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.683 0.393 . . . . 0.0 111.871 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.449 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 24.0 mmm-85 -61.01 -68.76 0.28 Allowed 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 111.597 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -31.64 37.25 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.95 179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.484 ' HB3' ' HG ' ' B' ' 24' ' ' LEU . 20.7 mm-40 -86.51 -10.47 54.04 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.289 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.15 14.22 68.21 Favored Glycine 0 C--N 1.341 0.809 0 C-N-CA 120.499 -0.858 . . . . 0.0 111.582 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.582 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 90.5 mt -86.8 166.77 14.97 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.56 0.695 . . . . 0.0 111.844 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 83.7 p -103.44 164.34 11.71 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.355 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -43.54 -35.98 1.89 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -179.351 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.59 -56.63 3.41 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.254 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.555 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.1 mt-10 -58.89 -15.34 12.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.612 0.244 . . . . 0.0 110.386 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.891 ' CG ' HD22 ' B' ' 15' ' ' LEU . 1.7 tpt -79.29 -48.1 14.72 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 122.6 1.19 . . . . 0.0 108.227 177.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.855 HD13 HD21 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.58 -33.89 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.037 0 CA-C-N 113.191 -1.822 . . . . 0.0 113.436 -177.36 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.405 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -67.65 -45.93 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.798 0.809 . . . . 0.0 109.933 178.291 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.0 OUTLIER -66.77 -37.43 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 114.277 -1.329 . . . . 0.0 112.192 -178.916 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.563 ' HA ' ' CG ' ' A' ' 37' ' ' TYR . . . -61.26 -47.54 85.55 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 122.031 0.92 . . . . 0.0 109.662 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.048 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -68.98 -42.8 76.07 Favored 'General case' 0 N--CA 1.401 -2.881 0 CA-C-N 113.34 -1.755 . . . . 0.0 111.121 -177.908 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 35' ' ' GLN . . . . . 1.048 ' N ' HD13 ' B' ' 34' ' ' LEU . 24.2 mt-30 -64.3 -19.32 65.34 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -94.29 27.29 2.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.179 0.514 . . . . 0.0 109.647 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.688 ' CD1' ' CE1' ' A' ' 36' ' ' HIS . 7.9 t80 -103.16 156.02 18.0 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.494 -178.386 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.419 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.06 0 C-N-CA 124.449 1.1 . . . . 0.0 112.334 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.618 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 3.6 ttt85 . . . . . 0 N--CA 1.486 1.353 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -78.26 124.79 28.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.436 HD22 HD22 ' B' ' 12' ' ' LEU . 2.0 tp -138.61 141.03 39.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.308 -178.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.655 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -106.3 136.53 45.86 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 178.286 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.889 HD12 HG21 ' B' ' 30' ' ' ILE . 4.9 pt -146.95 175.5 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.597 ' C ' HD22 ' A' ' 7' ' ' LEU . 75.0 t-105 -98.78 109.17 21.97 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -177.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.869 HD11 ' CG2' ' B' ' 30' ' ' ILE . 0.9 OUTLIER -131.26 117.18 18.63 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.939 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.556 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 14.9 p -82.86 178.02 8.37 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 121.783 0.802 . . . . 0.0 111.969 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -53.88 -50.43 66.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.962 -1.472 . . . . 0.0 111.788 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.3 -35.9 3.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.229 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.847 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -101.01 -15.97 17.29 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 8' ' ' SER . 78.8 mt -69.58 -38.96 77.57 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 105.474 -2.047 . . . . 0.0 105.474 175.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -61.16 -41.09 96.14 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 113.226 -1.806 . . . . 0.0 107.502 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.847 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -53.58 -48.42 69.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.028 178.075 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.044 HD21 HD13 ' B' ' 34' ' ' LEU . 19.2 mt -80.41 16.07 1.43 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.478 -0.783 . . . . 0.0 113.099 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.563 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -100.41 -44.69 5.82 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.632 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.563 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 7.2 mttm -88.75 -38.74 14.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.703 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.549 ' CE ' HD23 ' A' ' 15' ' ' LEU . 46.8 mtm -66.28 -70.6 0.23 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.497 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.856 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -27.7 -32.1 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 125.081 1.352 . . . . 0.0 114.161 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.469 ' N ' ' O ' ' A' ' 18' ' ' MET . 1.5 mtt-85 -66.14 -120.71 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.08 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -23.3 12.51 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.924 -0.485 . . . . 0.0 111.673 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 17.0 mt-10 -108.37 -7.08 15.95 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 115.632 1.716 . . . . 0.0 115.632 -177.26 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.856 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -143.46 18.49 2.26 Favored Glycine 0 CA--C 1.504 -0.621 0 C-N-CA 116.075 -2.964 . . . . 0.0 117.262 -176.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.689 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER 53.46 -159.52 0.14 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 119.54 1.67 . . . . 0.0 113.0 175.781 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.463 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 14.8 p -66.22 158.92 27.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.635 -1.166 . . . . 0.0 109.852 178.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.52 -38.73 4.35 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.9 m -79.51 -52.65 7.75 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 122.089 0.156 . . . . 0.0 111.072 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.603 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -57.26 -27.39 62.05 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.26 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.986 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -64.53 -47.83 77.38 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 122.973 1.368 . . . . 0.0 108.824 177.525 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.6 HG22 HD11 ' B' ' 7' ' ' LEU . 0.4 OUTLIER -75.57 -27.83 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.499 0 CA-C-N 112.671 -2.059 . . . . 0.0 114.268 -176.389 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.36 -52.01 15.35 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.812 0.815 . . . . 0.0 109.277 177.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -55.22 -40.18 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-N 113.75 -1.568 . . . . 0.0 111.077 -179.516 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.691 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.34 -40.42 49.11 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.61 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.862 HD22 ' SD ' ' B' ' 29' ' ' MET . 12.1 mt -74.92 -35.49 62.19 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.256 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -74.41 -11.1 60.15 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.5 m80 -106.61 -46.86 3.89 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 117.089 -0.05 . . . . 0.0 110.967 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.696 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 12.0 t80 -41.65 147.68 0.18 Allowed 'General case' 0 CA--C 1.541 0.607 0 O-C-N 123.275 0.359 . . . . 0.0 111.836 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.523 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 6.0 tppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.171 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -95.33 105.81 17.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -121.45 142.87 49.61 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.957 -178.045 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.655 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -108.29 137.47 46.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 177.836 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.861 HD13 HD13 ' B' ' 7' ' ' LEU . 2.4 pp -151.59 167.88 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 121.179 0.514 . . . . 0.0 112.374 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -83.63 94.48 8.11 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.925 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.861 HD13 HD13 ' B' ' 5' ' ' ILE . 0.9 OUTLIER -129.29 99.89 5.39 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.216 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.618 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 52.3 p -72.66 -135.86 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.353 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.19 -151.7 0.27 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.891 -0.141 . . . . 0.0 111.295 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' GLN . . . . . 0.412 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.9 tt0 33.92 43.62 0.07 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.502 0.721 . . . . 0.0 112.634 179.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.689 ' CA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -173.24 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.705 179.189 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.734 HD21 ' HB3' ' B' ' 7' ' ' LEU . 22.8 mt -76.55 -42.0 44.57 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.44 -41.21 40.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.483 -1.689 . . . . 0.0 108.293 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.689 ' HB2' ' CA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.28 -17.37 1.74 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.424 179.008 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.051 HD13 ' HB2' ' B' ' 18' ' ' MET . 0.2 OUTLIER -71.59 21.04 0.05 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -179.683 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.17 -56.8 12.2 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 122.251 -0.281 . . . . 0.0 111.155 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 4.6 mtpm? -91.83 -2.05 57.06 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' MET . . . . . 1.051 ' HB2' HD13 ' B' ' 15' ' ' LEU . 3.9 mtm -96.99 -32.79 11.83 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.91 ' HB2' HD12 ' B' ' 15' ' ' LEU . . . -99.33 -73.3 0.63 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.475 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 0.2 OUTLIER -55.97 -62.41 1.72 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.556 0.694 . . . . 0.0 111.47 -179.371 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ARG . . . . . 0.667 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.01 -28.0 3.63 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.708 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.943 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -87.97 -30.72 19.82 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.014 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.97 -7.48 31.22 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.886 -0.673 . . . . 0.0 114.519 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.943 HD13 ' CG ' ' B' ' 22' ' ' GLU . 0.0 OUTLIER -93.9 -174.02 3.31 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.096 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 96.4 p -103.97 164.2 11.86 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.099 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.1 OUTLIER -45.58 -40.47 8.84 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.279 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.596 ' HB2' ' HB3' ' A' ' 6' ' ' TRP . 59.8 p -81.43 -50.5 9.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.421 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.7 mm-40 -59.29 -20.1 51.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.72 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.985 ' SD ' HD21 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -72.22 -39.85 68.23 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 122.629 1.204 . . . . 0.0 108.63 177.469 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.889 HG21 HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -77.88 -38.09 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.482 0 CA-C-N 112.636 -2.074 . . . . 0.0 113.262 -175.494 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.8 -44.56 96.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 122.671 1.224 . . . . 0.0 107.815 175.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.421 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.4 t -59.97 -44.94 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 CA-C-N 112.271 -2.24 . . . . 0.0 111.872 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.696 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -51.8 -33.63 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.294 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.044 HD13 HD21 ' A' ' 15' ' ' LEU . 15.6 mt -76.4 -32.96 58.84 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.442 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -79.41 -16.72 55.71 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -123.73 21.18 9.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.17 0.441 . . . . 0.0 111.324 176.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.57 131.57 37.91 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.793 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.452 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.722 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.816 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.167 0.508 . . . . 0.0 112.104 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -92.02 120.58 32.79 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.56 ' HB3' HD23 ' B' ' 7' ' ' LEU . 2.8 tp -117.45 142.26 47.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.919 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -130.53 125.61 34.72 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.93 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.763 HD11 HG21 ' B' ' 30' ' ' ILE . 2.1 pt -152.02 -178.92 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.476 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.5 t-105 -94.72 98.38 10.74 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -177.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.903 HD11 HG22 ' B' ' 30' ' ' ILE . 1.5 mm? -125.09 111.34 15.23 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.5 t -76.8 -125.07 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 8.9 t70 -95.9 -45.47 6.93 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.412 ' HB3' ' NE2' ' B' ' 35' ' ' GLN . 24.1 mp0 -68.43 45.41 0.04 OUTLIER 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.187 0.595 . . . . 0.0 112.005 -178.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.836 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.5 t -170.62 -42.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 31.4 mt -72.66 -39.82 66.81 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.582 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 0.2 OUTLIER -68.7 -39.58 80.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 113.511 -1.677 . . . . 0.0 107.033 176.01 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.836 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -48.3 -37.93 17.64 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.097 -1.411 . . . . 0.0 109.203 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.036 HD21 HD13 ' B' ' 34' ' ' LEU . 42.4 mt -84.86 33.39 0.53 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.811 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -107.55 -58.03 2.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.03 -33.47 61.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.734 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.644 ' CE ' HD23 ' A' ' 15' ' ' LEU . 33.4 mtm -74.84 -67.42 0.64 Allowed 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.019 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.869 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -28.87 -31.57 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.857 1.263 . . . . 0.0 114.121 -178.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' A' ' 18' ' ' MET . 3.7 mtt-85 -66.78 -118.23 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.151 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.086 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.58 -22.87 24.08 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 122.003 -0.435 . . . . 0.0 111.778 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.525 ' HG3' ' HD3' ' B' ' 38' ' ' LYS . 24.3 mm-40 -109.3 -5.8 15.74 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -177.082 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.869 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -144.49 16.96 2.05 Favored Glycine 0 C--O 1.221 -0.701 0 C-N-CA 116.274 -2.87 . . . . 0.0 117.183 -176.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.661 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER 53.04 -161.83 0.11 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 119.496 1.648 . . . . 0.0 113.38 175.925 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -59.89 166.73 2.52 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.97 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -57.63 -42.68 83.87 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.98 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 94.2 p -74.24 -46.11 43.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.711 0.291 . . . . 0.0 110.273 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.528 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.5 mt-10 -61.08 -35.23 76.43 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.777 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.96 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -62.4 -47.95 81.88 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 123.64 1.686 . . . . 0.0 108.687 177.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.039 HG21 HD13 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -67.86 -15.68 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.979 0 CA-C-N 112.876 -1.965 . . . . 0.0 112.876 -177.572 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.3 -46.49 12.56 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.002 176.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.817 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -60.59 -34.86 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.978 0 CA-C-O 121.596 0.712 . . . . 0.0 109.217 177.922 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.961 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.28 -46.76 0.55 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.814 -1.539 . . . . 0.0 111.057 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.031 HD13 HD21 ' B' ' 15' ' ' LEU . 6.3 mt -87.26 -29.72 21.45 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.184 -178.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -83.64 -15.65 48.14 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.961 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -114.64 -4.46 12.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 -179.499 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.698 ' CD2' ' HD3' ' A' ' 38' ' ' LYS . 4.4 t80 -69.03 157.42 36.83 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.698 ' HD3' ' CD2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.181 0 C-N-CA 124.752 1.221 . . . . 0.0 112.899 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.375 0.131 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -81.43 121.52 26.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.68 140.55 50.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.469 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.919 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.84 129.86 56.34 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.466 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.062 HD12 HD21 ' B' ' 7' ' ' LEU . 1.4 pp -156.6 174.41 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.515 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.8 t-105 -91.76 116.11 28.62 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 1.062 HD21 HD12 ' B' ' 5' ' ' ILE . 0.6 OUTLIER -129.03 127.91 42.56 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 177.184 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.922 ' C ' HD23 ' B' ' 12' ' ' LEU . 7.9 p -82.13 -178.33 6.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 121.831 0.825 . . . . 0.0 111.1 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ASP . . . . . 0.448 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 11.2 t70 -58.36 -44.99 89.06 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.309 -1.314 . . . . 0.0 113.172 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -75.68 40.53 0.19 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.089 0.471 . . . . 0.0 111.939 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.725 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 10.7 t -173.6 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.671 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.922 HD23 ' C ' ' B' ' 8' ' ' SER . 0.4 OUTLIER -61.18 -30.12 70.21 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.048 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.554 ' HG2' ' HG ' ' B' ' 12' ' ' LEU . 2.5 mm-40 -99.52 -36.07 9.67 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.974 -1.466 . . . . 0.0 109.584 177.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.725 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -42.91 -33.41 0.78 Allowed 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.881 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.031 HD21 HD13 ' A' ' 34' ' ' LEU . 49.1 mt -66.74 12.38 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -75.22 -52.47 10.83 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -93.76 -10.15 35.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.692 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.621 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 11.6 mtp -87.11 -21.28 26.11 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.682 0.277 . . . . 0.0 110.966 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.35 -67.93 0.82 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.826 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.8 mmm180 -58.93 -70.28 0.16 Allowed 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.57 -33.6 6.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.796 -179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.621 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 3.8 mm-40 -82.2 -25.41 34.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.291 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 98.6 64.38 0.86 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.439 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.81 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 179.21 178.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.209 0.528 . . . . 0.0 111.634 177.945 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 25' ' ' SER . . . . . 0.551 ' N ' HD23 ' B' ' 24' ' ' LEU . 0.8 OUTLIER -105.2 169.08 8.65 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.71 -178.521 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.89 -41.3 11.17 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.7 p -78.09 -50.65 11.62 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.445 0.164 . . . . 0.0 110.986 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.568 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.1 mm-40 -65.52 -10.6 36.23 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.412 178.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.877 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.9 tpt -84.34 -48.45 9.69 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 122.689 1.233 . . . . 0.0 107.788 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.903 HG22 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -74.13 -34.91 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.95 0 CA-C-N 113.017 -1.901 . . . . 0.0 112.952 -177.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.91 -48.24 72.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 122.384 1.088 . . . . 0.0 109.032 177.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.449 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -58.73 -43.79 88.6 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.174 0 CA-C-N 112.865 -1.97 . . . . 0.0 111.671 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.869 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.32 -31.34 3.81 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.005 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.036 HD13 HD21 ' A' ' 15' ' ' LEU . 14.2 mt -91.86 -31.76 15.58 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 35' ' ' GLN . . . . . 0.412 ' NE2' ' HB3' ' A' ' 10' ' ' GLN . 24.7 mt-30 -72.07 -15.03 62.01 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -111.23 19.81 17.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.114 0.415 . . . . 0.0 111.397 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.495 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 58.6 t80 -114.75 165.61 12.63 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.962 0.41 . . . . 0.0 111.823 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.525 ' HD3' ' HG3' ' A' ' 22' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.162 0 C-N-CA 123.869 0.868 . . . . 0.0 112.603 178.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.582 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.696 0.284 . . . . 0.0 111.695 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.41 126.6 31.06 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -125.35 137.7 54.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.684 -178.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.955 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -115.98 121.51 42.49 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.231 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.902 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -145.86 176.3 1.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -177.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.628 ' O ' HD13 ' A' ' 7' ' ' LEU . 68.6 t-105 -94.02 100.83 12.89 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -177.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.856 HD21 HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -128.78 111.47 13.15 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 177.318 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.572 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 10.0 p -82.37 -176.79 6.39 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 121.724 0.774 . . . . 0.0 112.487 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -50.56 -47.78 57.72 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.474 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -47.03 -31.2 3.11 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.909 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -109.97 -15.29 14.09 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.5 mt -73.83 -41.04 62.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 105.901 -1.888 . . . . 0.0 105.901 176.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.41 -39.12 93.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.333 -1.758 . . . . 0.0 107.996 175.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.909 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -52.08 -44.68 64.47 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.558 178.78 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.041 ' CD2' HD13 ' B' ' 34' ' ' LEU . 19.6 mt -76.82 13.7 0.98 Allowed 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.3 mm-40 -98.9 -51.61 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 19.1 mttp -73.73 -26.1 60.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.211 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.67 ' CE ' HD23 ' A' ' 15' ' ' LEU . 58.8 mtm -81.71 -74.75 0.32 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.933 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.68 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.94 -43.42 3.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 122.908 0.483 . . . . 0.0 112.1 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.1 mmm180 -63.71 -69.7 0.26 Allowed 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -51.36 -34.32 33.49 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.879 179.643 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -82.9 -11.39 58.22 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.184 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.14 7.22 76.51 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.592 -178.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.68 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 94.9 mt -82.75 168.01 17.61 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.523 0.678 . . . . 0.0 111.305 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.6 p -108.71 164.61 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.973 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.519 ' HB3' HG21 ' B' ' 5' ' ' ILE . 2.4 mttm -46.24 -31.97 2.78 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.418 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.1 m -84.29 -59.23 2.45 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 122.178 0.191 . . . . 0.0 111.139 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.582 ' HB3' HD22 ' A' ' 24' ' ' LEU . 2.8 mm-40 -59.72 -12.64 7.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.159 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' MET . . . . . 1.037 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.0 tpt -82.29 -47.17 12.71 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.855 1.312 . . . . 0.0 107.746 177.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.918 HD11 HD11 ' B' ' 34' ' ' LEU . 0.6 OUTLIER -75.55 -32.01 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 CA-C-N 112.847 -1.978 . . . . 0.0 113.782 -177.818 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.542 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -69.45 -48.81 59.66 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.185 0.993 . . . . 0.0 109.345 178.011 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.424 ' N ' HD22 ' A' ' 31' ' ' ASN . 1.6 t -59.22 -42.93 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.145 -1.843 . . . . 0.0 110.911 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.802 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -44.73 -41.62 6.98 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.331 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.854 HD23 ' CB ' ' B' ' 33' ' ' ALA . 8.2 mt -74.87 -33.98 62.16 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.836 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -70.95 -14.7 62.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.44 30.34 2.64 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.711 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -77.57 133.52 38.46 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 178.664 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.563 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 120.724 0.297 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -91.61 116.38 28.83 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.482 ' HB3' HD23 ' A' ' 7' ' ' LEU . 4.9 tp -116.46 139.43 50.46 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.736 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.955 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -122.95 123.47 40.99 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.239 178.662 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.803 HD12 HD21 ' B' ' 7' ' ' LEU . 1.3 pt -149.33 179.92 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.616 ' O ' HD13 ' B' ' 7' ' ' LEU . 71.1 t-105 -93.15 89.47 6.47 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.803 HD21 HD12 ' B' ' 5' ' ' ILE . 1.3 mm? -128.57 100.22 5.67 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.582 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 53.2 p -57.11 170.94 0.41 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 122.119 0.962 . . . . 0.0 112.779 -177.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.55 -40.0 94.79 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.319 -178.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' GLN . . . . . 0.492 ' O ' ' HB2' ' B' ' 14' ' ' ASP . 3.5 mm-40 -66.53 9.56 0.17 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.679 ' HA ' ' HB3' ' B' ' 14' ' ' ASP . 3.0 t -145.72 19.17 1.48 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' B' ' 8' ' ' SER . 13.0 mt -107.79 -46.4 3.8 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 175.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -88.02 -26.6 22.51 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 114.492 -1.231 . . . . 0.0 108.946 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.679 ' HB3' ' HA ' ' B' ' 11' ' ' THR . 6.5 t70 -55.77 -6.43 0.21 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 113.654 -1.612 . . . . 0.0 113.165 -179.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.955 HD23 ' SD ' ' B' ' 29' ' ' MET . 0.0 OUTLIER -135.86 35.06 2.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 121.357 0.599 . . . . 0.0 111.407 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.462 ' HB2' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -51.22 -31.5 20.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.721 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 9.3 mtpp -62.14 -24.7 67.32 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.078 0.466 . . . . 0.0 110.794 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.78 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 8.6 mtm -86.64 -25.05 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.052 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.611 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -100.3 -73.52 0.63 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.719 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.462 ' HD2' ' HB2' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -56.95 -65.05 0.68 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.163 0.506 . . . . 0.0 112.092 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 13.0 mmp_? -50.54 -27.53 6.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.38 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.862 ' HG2' HD12 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -91.65 -23.69 19.76 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.004 179.524 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.82 -5.55 34.76 Favored Glycine 0 C--N 1.34 0.75 0 C-N-CA 121.342 -0.456 . . . . 0.0 112.405 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.862 HD12 ' HG2' ' B' ' 22' ' ' GLU . 53.5 mt -80.59 178.52 8.29 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.664 0.745 . . . . 0.0 112.017 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 25' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' B' ' 29' ' ' MET . 3.7 t -120.15 179.9 4.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.723 178.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.82 -38.56 61.47 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.026 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.3 m -86.36 -51.31 6.31 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 121.91 0.084 . . . . 0.0 111.087 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.621 ' HB3' HD22 ' B' ' 24' ' ' LEU . 1.6 mm-40 -62.88 -9.3 9.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.413 178.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.955 ' SD ' HD23 ' B' ' 15' ' ' LEU . 4.9 tpt -79.93 -47.79 14.46 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 123.095 1.426 . . . . 0.0 107.685 177.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.902 HG21 HD11 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -79.37 -28.77 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 CA-C-N 112.213 -2.267 . . . . 0.0 114.191 -176.694 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -49.38 51.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.214 1.007 . . . . 0.0 109.087 177.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 2.0 t -56.94 -47.12 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.1 -1.864 . . . . 0.0 110.266 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.854 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -48.84 -37.1 18.47 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.225 178.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.041 HD13 ' CD2' ' A' ' 15' ' ' LEU . 12.9 mt -72.46 -34.87 68.04 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.058 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -79.09 -14.63 59.02 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -130.75 19.87 5.09 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.692 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -73.03 137.02 45.11 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 178.863 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.708 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 1.4 mmpt? . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.718 178.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.432 ' HG2' HD21 ' A' ' 3' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.29 121.53 24.54 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.3 mm? -126.43 141.65 51.81 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.3 OUTLIER -125.55 117.81 24.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.463 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.95 HD11 HG21 ' B' ' 30' ' ' ILE . 4.4 pt -147.33 175.56 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -92.99 98.77 11.57 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 -177.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.927 HD21 HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -119.28 115.38 24.05 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.623 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.0 p -71.58 -134.94 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.425 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.4 t70 -101.21 -41.09 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -73.11 38.97 0.09 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.123 0.487 . . . . 0.0 111.914 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.823 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.7 t -160.59 -43.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.676 HD21 ' HB2' ' A' ' 7' ' ' LEU . 53.8 mt -68.97 -41.04 78.47 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 175.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.65 -39.74 91.7 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 113.425 -1.716 . . . . 0.0 108.065 176.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.823 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t0 -48.0 -36.6 13.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 114.552 -1.203 . . . . 0.0 109.352 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.091 HD21 HD13 ' B' ' 34' ' ' LEU . 43.0 mt -79.85 27.2 0.3 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.099 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -100.86 -59.08 1.76 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -79.61 -5.93 56.04 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.573 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.774 ' CE ' HD23 ' A' ' 15' ' ' LEU . 43.6 mtm -100.99 -66.05 0.93 Allowed 'General case' 0 C--N 1.341 0.228 0 CA-C-N 116.993 -0.094 . . . . 0.0 110.837 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.822 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -29.23 -32.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.388 1.075 . . . . 0.0 113.613 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.49 ' CG ' ' N ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -62.54 -139.85 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.733 177.852 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.49 ' N ' ' CG ' ' A' ' 20' ' ' ARG . 0.1 OUTLIER -41.29 -24.1 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.587 -0.695 . . . . 0.0 112.243 179.037 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 18' ' ' MET . 15.5 mm-40 -100.73 -13.0 18.67 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.158 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.822 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -142.09 17.22 2.54 Favored Glycine 0 C--O 1.223 -0.557 0 C-N-CA 116.759 -2.638 . . . . 0.0 116.973 -176.336 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.699 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.1 mp 52.79 -162.36 0.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 119.512 1.656 . . . . 0.0 112.996 176.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.467 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 1.7 p -61.4 161.09 9.8 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.509 -1.223 . . . . 0.0 109.714 178.126 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.87 -41.59 33.74 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.78 ' HA ' HD12 ' B' ' 5' ' ' ILE . 91.7 p -76.47 -51.72 11.22 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.574 ' O ' HG22 ' A' ' 32' ' ' VAL . 6.3 mt-10 -54.89 -31.22 59.72 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.956 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.5 tpt -64.47 -49.93 69.48 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 123.416 1.579 . . . . 0.0 108.877 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.018 HG21 HD11 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -66.37 -19.39 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.801 0 CA-C-N 113.325 -1.761 . . . . 0.0 112.813 -177.703 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.457 ' OD1' HG21 ' B' ' 11' ' ' THR . 0.0 OUTLIER -79.27 -51.57 9.28 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.634 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.793 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -53.41 -36.17 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.972 0 CA-C-O 121.499 0.666 . . . . 0.0 109.906 178.371 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.839 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.85 -47.68 0.7 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.034 -1.439 . . . . 0.0 111.18 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.045 HD13 ' CD2' ' B' ' 15' ' ' LEU . 5.6 mt -83.92 -25.41 30.18 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.049 -178.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -87.92 -9.21 54.33 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.241 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.839 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -136.24 22.22 3.22 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.78 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -88.29 140.45 29.46 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.04 0.536 . . . . 0.0 110.702 179.195 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.569 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.458 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.591 0.234 . . . . 0.0 111.61 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -85.41 123.3 30.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.451 ' HA ' HD13 ' B' ' 3' ' ' LEU . 2.7 mm? -129.12 148.56 51.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.913 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -133.77 121.43 21.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.781 179.176 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.018 HD11 HG21 ' A' ' 30' ' ' ILE . 5.0 pt -148.89 179.71 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.545 ' O ' HD13 ' B' ' 7' ' ' LEU . 75.2 t-105 -97.12 101.99 13.67 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -177.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.855 HD21 HG13 ' B' ' 5' ' ' ILE . 0.7 OUTLIER -126.86 117.01 21.74 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 18.4 p -73.18 -149.15 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.015 0.436 . . . . 0.0 111.343 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ASP . . . . . 0.459 ' O ' HG22 ' B' ' 11' ' ' THR . 16.7 m-20 -96.22 -150.2 0.32 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.238 -178.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' GLN . . . . . 0.412 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 0.9 OUTLIER 35.55 43.15 0.15 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.251 0.62 . . . . 0.0 112.437 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.747 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 4.1 t -172.43 -46.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.403 ' HA ' HD12 ' A' ' 34' ' ' LEU . 19.0 mt -74.19 -39.2 63.33 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -89.63 -36.13 15.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 113.281 -1.781 . . . . 0.0 109.871 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.747 ' HB2' ' N ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -47.67 -25.45 1.2 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.32 -179.089 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.045 ' CD2' HD13 ' A' ' 34' ' ' LEU . 4.2 pp -83.81 34.18 0.49 Allowed 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 30.3 mm-40 -53.76 -28.21 33.33 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 3.3 mmtp -97.53 -5.94 34.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.714 ' HB2' ' HB2' ' B' ' 15' ' ' LEU . 14.2 mtm -89.84 -80.43 0.31 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.838 0.29 . . . . 0.0 110.562 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.69 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -49.03 -44.42 41.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.783 0.433 . . . . 0.0 111.846 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.475 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 2.2 mmm180 -62.74 -68.81 0.3 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 111.807 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -52.17 -32.6 36.72 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.981 179.488 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.535 ' HB3' ' HG ' ' B' ' 24' ' ' LEU . 21.4 mm-40 -84.9 -11.31 55.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.061 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.64 10.13 75.52 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.281 -177.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.69 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 92.4 mt -83.22 165.08 19.73 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.583 0.706 . . . . 0.0 111.58 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 72.6 p -107.26 164.71 11.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.141 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.13 -37.48 1.44 Allowed 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 3.4 t -82.42 -56.9 3.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.597 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.7 mm-40 -60.19 -14.22 16.35 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.887 0.375 . . . . 0.0 110.761 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.749 ' SD ' HD22 ' B' ' 15' ' ' LEU . 3.1 tpt -79.23 -46.39 17.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.831 1.3 . . . . 0.0 108.24 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.95 HG21 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -78.06 -31.34 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.104 0 CA-C-N 112.656 -2.066 . . . . 0.0 113.594 -177.26 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.496 HD21 HG21 ' A' ' 11' ' ' THR . 0.4 OUTLIER -68.67 -48.38 64.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.24 1.019 . . . . 0.0 109.331 177.768 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 1.4 t -59.75 -43.0 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 CA-C-N 113.071 -1.877 . . . . 0.0 111.154 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.831 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -46.28 -34.43 4.46 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.114 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.091 HD13 HD21 ' A' ' 15' ' ' LEU . 13.5 mt -88.94 -28.48 20.24 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -74.8 -11.01 60.05 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -123.27 27.06 7.69 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.593 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 33.7 t80 -115.99 155.21 28.47 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 111.723 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.431 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.227 178.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.625 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.6 mpt_? . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.951 0.405 . . . . 0.0 111.735 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -107.71 109.23 20.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.56 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.441 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 2.2 tp -127.99 147.21 50.49 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.206 -178.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.755 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -108.84 138.21 45.54 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.544 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.844 ' CD1' HG21 ' B' ' 30' ' ' ILE . 2.1 pt -148.5 -179.9 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.546 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.0 t-105 -97.13 93.72 6.72 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -177.42 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.849 HD11 HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -125.78 103.67 7.93 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.896 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.566 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.1 p -74.38 -176.11 2.56 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.781 0.8 . . . . 0.0 112.439 -178.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.5 -49.03 65.58 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.689 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -46.05 -34.23 3.96 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.935 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -100.45 -22.38 15.05 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 8' ' ' SER . 59.9 mt -71.55 -39.89 70.36 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 176.644 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.89 -40.61 96.9 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 113.427 -1.715 . . . . 0.0 107.53 175.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.935 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -51.17 -43.29 61.27 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.513 -1.221 . . . . 0.0 108.923 178.138 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.063 HD21 HD13 ' B' ' 34' ' ' LEU . 25.0 mt -86.42 26.43 1.07 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -106.25 -53.42 2.63 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -76.3 -39.62 53.7 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.369 178.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.504 ' HE3' ' SD ' ' A' ' 29' ' ' MET . 35.4 mtm -68.24 -71.77 0.2 Allowed 'General case' 0 C--N 1.341 0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.655 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.843 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -28.08 -32.09 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.165 1.386 . . . . 0.0 114.302 -178.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.8 mmm180 -65.66 -121.92 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.398 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.52 -22.62 8.54 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.824 -0.547 . . . . 0.0 111.654 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -108.1 -7.68 16.02 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 -177.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.843 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -144.18 19.62 2.11 Favored Glycine 0 CA--C 1.504 -0.617 0 C-N-CA 116.015 -2.993 . . . . 0.0 117.416 -176.446 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.684 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER 52.61 -160.06 0.12 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 119.576 1.688 . . . . 0.0 113.052 175.841 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.468 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 12.9 p -64.02 159.54 19.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.787 178.217 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.55 -38.84 6.81 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.763 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 22.3 m -81.51 -51.17 8.56 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 111.325 0.121 . . . . 0.0 111.325 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.539 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 4.4 mt-10 -56.56 -27.17 57.16 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' MET . . . . . 1.019 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.8 tpt -63.26 -47.69 81.33 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 122.951 1.357 . . . . 0.0 108.996 177.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.012 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -76.95 -36.74 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.599 0 CA-C-N 112.678 -2.055 . . . . 0.0 114.29 -176.456 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.425 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -63.5 -47.06 83.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.015 0.912 . . . . 0.0 108.927 178.04 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.65 -42.78 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.503 0 CA-C-N 113.431 -1.713 . . . . 0.0 110.795 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.76 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -52.59 -38.92 61.0 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.965 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.113 HD13 HD21 ' B' ' 15' ' ' LEU . 13.9 mt -73.98 -29.86 62.19 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.59 -178.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -78.39 -18.6 54.82 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.965 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -107.0 -36.67 6.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.615 ' CE2' ' HB3' ' B' ' 18' ' ' MET . 2.7 t80 -29.06 134.05 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.259 0.623 . . . . 0.0 111.891 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.853 -1.07 . . . . 0.0 112.892 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -82.4 108.99 16.25 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.0 tp -130.26 145.38 51.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.182 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.755 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.0 OUTLIER -103.6 139.61 38.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.552 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.012 HD12 HG21 ' A' ' 30' ' ' ILE . 3.5 pt -148.17 179.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.159 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.763 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.8 t-105 -98.66 100.36 11.58 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -177.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.773 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -133.22 114.04 13.36 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 177.378 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.625 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -94.85 -166.35 1.45 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.524 0.678 . . . . 0.0 112.347 -178.244 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -44.93 -63.61 0.88 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.729 -1.123 . . . . 0.0 112.871 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -53.15 -27.23 20.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.664 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 70.0 p -91.08 -34.52 15.05 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' B' ' 8' ' ' SER . 56.2 mt -67.61 -37.96 83.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -43.35 88.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 113.561 -1.654 . . . . 0.0 107.526 176.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.664 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -52.58 -44.02 65.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.406 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.113 HD21 HD13 ' A' ' 34' ' ' LEU . 16.5 mt -76.29 29.64 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -114.56 -57.5 2.26 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.42 -31.56 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.636 178.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.796 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 7.9 mtm -82.51 -16.15 49.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.866 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.75 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.73 -65.28 0.97 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.858 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mtp-105 -60.89 -65.91 0.62 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.127 0.489 . . . . 0.0 111.533 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.19 -29.87 6.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.863 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.82 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -85.47 -35.31 21.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.631 179.525 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 0.455 ' N ' ' HG3' ' B' ' 22' ' ' GLU . . . 106.56 67.81 0.67 Allowed Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.919 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.82 HD13 ' CG ' ' B' ' 22' ' ' GLU . 0.0 OUTLIER -178.26 -177.34 0.57 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.272 0.558 . . . . 0.0 112.059 178.299 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 25' ' ' SER . . . . . 0.419 ' N ' HD23 ' B' ' 24' ' ' LEU . 19.1 p -110.81 170.75 7.89 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.121 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.432 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.8 mttm -40.88 -38.73 1.0 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -179.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 1.5 p -79.05 -56.66 4.21 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 117.838 0.29 . . . . 0.0 111.612 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.684 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.1 mt-10 -61.55 -15.63 40.35 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 29' ' ' MET . . . . . 1.045 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.7 tpt -77.15 -48.28 18.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 122.743 1.259 . . . . 0.0 108.279 178.141 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.88 HD11 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.88 -31.75 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.164 0 CA-C-N 112.885 -1.962 . . . . 0.0 113.462 -177.358 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.534 HD21 ' HB ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -68.41 -47.92 66.01 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 122.271 1.034 . . . . 0.0 108.871 177.449 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.421 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.7 t -57.98 -44.69 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.038 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.723 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -49.09 -30.52 6.58 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.033 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.063 HD13 HD21 ' A' ' 15' ' ' LEU . 15.5 mt -80.93 -35.66 32.07 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.996 -177.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -77.86 -11.62 59.91 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -125.19 18.81 8.32 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.651 0.262 . . . . 0.0 111.215 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.42 132.59 38.57 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.767 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.695 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.605 178.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.695 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.493 ' C ' HD22 ' A' ' 3' ' ' LEU . 92.7 m95 -88.4 118.92 28.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.531 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.3 mm? -136.92 148.64 47.11 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.382 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.851 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -121.09 130.47 53.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 178.799 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.774 HD12 HD21 ' A' ' 7' ' ' LEU . 1.3 pt -147.79 -179.79 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.452 ' C ' HD22 ' A' ' 7' ' ' LEU . 69.3 t-105 -95.2 89.26 5.45 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.774 HD21 HD12 ' A' ' 5' ' ' ILE . 2.1 mm? -120.58 99.36 6.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 p -74.8 -141.04 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.208 -178.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.697 ' O ' HG22 ' A' ' 11' ' ' THR . 2.5 p-10 -79.58 -155.33 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.733 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.439 ' O ' ' HB ' ' A' ' 11' ' ' THR . 2.2 tt0 36.82 43.85 0.31 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.279 0.632 . . . . 0.0 112.412 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.697 HG22 ' O ' ' A' ' 9' ' ' ASP . 11.8 t -174.96 -48.2 0.01 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.096 -0.957 . . . . 0.0 112.152 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.627 HD11 ' O ' ' A' ' 7' ' ' LEU . 15.1 mt -78.23 -39.71 39.55 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 105.68 -1.97 . . . . 0.0 105.68 175.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -41.9 62.94 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 113.268 -1.787 . . . . 0.0 106.933 176.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.69 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.02 -27.3 7.53 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.017 -1.447 . . . . 0.0 109.569 178.231 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.248 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -76.64 31.34 0.13 Allowed 'General case' 0 N--CA 1.426 -1.643 0 C-N-CA 124.161 0.984 . . . . 0.0 113.044 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -74.65 -61.52 1.85 Allowed 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.288 -0.257 . . . . 0.0 111.535 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -98.11 7.2 46.65 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.825 ' HB2' HD13 ' A' ' 15' ' ' LEU . 23.2 mtm -88.18 -82.05 0.24 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.879 0.309 . . . . 0.0 111.617 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.83 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -23.87 -35.78 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 126.444 1.898 . . . . 0.0 114.286 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 18' ' ' MET . 5.0 mtt-85 -68.52 -117.97 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.087 179.226 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.9 -23.32 6.88 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 4.4 mt-10 -116.67 4.21 13.1 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -177.001 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.83 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -149.34 16.56 1.14 Allowed Glycine 0 CA--C 1.502 -0.729 0 C-N-CA 115.398 -3.286 . . . . 0.0 117.417 -177.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.571 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.1 mp 52.83 -158.54 0.14 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 119.792 1.796 . . . . 0.0 112.671 176.303 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -70.53 150.3 46.26 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.149 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -38.79 -39.43 0.51 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.451 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 m -81.12 -54.96 5.08 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 122.028 0.131 . . . . 0.0 110.734 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -55.32 -29.88 59.15 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' MET . . . . . 1.248 ' SD ' HD11 ' A' ' 15' ' ' LEU . 4.1 tpt -59.45 -47.49 85.3 Favored 'General case' 0 N--CA 1.44 -0.975 0 CA-C-O 123.028 1.394 . . . . 0.0 109.714 177.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.635 HD13 HD21 ' B' ' 34' ' ' LEU . 0.3 OUTLIER -75.77 -21.39 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.686 0 CA-C-N 112.257 -2.247 . . . . 0.0 113.779 -175.812 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.773 HD21 HG21 ' B' ' 11' ' ' THR . 0.6 OUTLIER -78.18 -51.57 10.02 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.983 0.897 . . . . 0.0 109.985 177.164 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.6 t -63.53 -34.98 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-N 113.705 -1.589 . . . . 0.0 111.155 -179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.8 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -46.9 -61.45 1.86 Allowed 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.339 -1.301 . . . . 0.0 112.438 -179.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.907 HD22 ' N ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -74.71 -28.09 60.66 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.048 -176.974 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.907 ' N ' HD22 ' A' ' 34' ' ' LEU . 9.2 mt-30 -56.55 -24.4 46.71 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.435 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -125.48 31.53 5.53 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.411 0.624 . . . . 0.0 109.505 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.807 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -87.85 139.38 30.58 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.171 179.896 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.555 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.123 -0.941 . . . . 0.0 111.187 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 2.2 ttt-85 . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -73.97 128.08 34.57 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -133.29 140.47 47.47 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.517 -178.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.851 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -121.55 130.25 53.41 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.619 HD13 HD13 ' B' ' 7' ' ' LEU . 2.3 pp -150.9 165.0 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -85.48 103.6 14.5 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.761 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.619 HD13 HD13 ' B' ' 5' ' ' ILE . 1.1 tp -124.69 113.87 18.57 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.252 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.904 ' O ' HD23 ' B' ' 12' ' ' LEU . 12.5 p -77.03 -173.44 2.74 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 121.449 0.642 . . . . 0.0 110.74 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -59.41 -155.77 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.562 -1.199 . . . . 0.0 112.528 -178.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' GLN . . . . . 0.517 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.7 tt0 37.45 39.84 0.19 Allowed 'General case' 0 C--N 1.344 0.349 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.773 HG21 HD21 ' A' ' 31' ' ' ASN . 1.2 t 177.61 -51.56 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.965 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.904 HD23 ' O ' ' B' ' 8' ' ' SER . 0.4 OUTLIER -70.64 -27.56 64.14 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.002 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.31 -43.41 6.96 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.415 -1.72 . . . . 0.0 107.66 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.696 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.7 m-20 -56.17 -16.4 5.18 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.201 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.83 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.1 OUTLIER -70.32 23.58 0.03 OUTLIER 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.84 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -87.61 -36.25 17.61 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 11.1 pttm -102.97 -1.92 28.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.819 ' SD ' HD22 ' B' ' 15' ' ' LEU . 53.3 mtp -91.45 -84.49 0.26 Allowed 'General case' 0 C--N 1.34 0.182 0 O-C-N 122.259 -0.276 . . . . 0.0 110.45 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.617 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -45.55 -45.28 13.41 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.343 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -69.18 0.24 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 120.966 0.412 . . . . 0.0 111.769 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -33.49 42.77 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -81.3 -12.18 59.13 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.916 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.29 85.58 Favored Glycine 0 C--N 1.34 0.786 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.569 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.8 HD22 ' HB3' ' B' ' 28' ' ' GLU . 96.5 mt -85.04 174.89 9.38 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.736 0.779 . . . . 0.0 111.392 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 19.4 p -116.58 172.71 7.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.747 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.455 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -48.96 -34.2 12.49 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.477 ' HA ' HD12 ' A' ' 5' ' ' ILE . 4.6 p -86.56 -54.52 4.35 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.446 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.8 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.0 mt-10 -60.02 -11.17 5.21 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.452 0.168 . . . . 0.0 111.038 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.83 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.4 tpt -84.36 -46.98 11.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.532 1.158 . . . . 0.0 107.995 177.335 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.636 HG22 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -76.38 -29.76 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.139 0 CA-C-N 113.038 -1.892 . . . . 0.0 113.132 -177.359 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.473 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -71.49 -50.92 26.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 122.206 1.003 . . . . 0.0 109.088 177.371 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 2.0 t -54.82 -41.58 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 CA-C-N 113.164 -1.835 . . . . 0.0 110.16 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.891 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . . . -43.36 -43.12 4.93 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.831 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.035 HD13 HD23 ' A' ' 15' ' ' LEU . 9.6 mt -79.27 -29.88 42.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.922 -177.286 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -78.56 -16.32 57.57 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -132.55 21.04 4.29 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.463 0.574 . . . . 0.0 112.293 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.543 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -74.79 139.03 43.01 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.178 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.47 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.853 -0.594 . . . . 0.0 112.474 178.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.742 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 121.146 0.498 . . . . 0.0 112.034 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -114.12 114.36 25.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.1 tp -129.14 138.42 51.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.429 -177.029 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.891 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -115.97 123.82 48.99 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.859 HG13 HD21 ' A' ' 7' ' ' LEU . 3.9 pt -145.85 178.84 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.521 0.564 . . . . 0.0 112.521 -177.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.559 ' O ' HD13 ' A' ' 7' ' ' LEU . 66.0 t-105 -90.91 98.33 11.71 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.859 HD21 HG13 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -130.24 107.78 9.54 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.686 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 23.0 t -72.45 -129.95 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -178.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.773 ' O ' HG22 ' A' ' 11' ' ' THR . 0.8 OUTLIER -97.74 -154.8 0.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -178.614 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.43 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.0 OUTLIER 34.95 45.96 0.18 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.28 0.632 . . . . 0.0 111.885 179.434 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.773 HG22 ' O ' ' A' ' 9' ' ' ASP . 13.9 t -174.78 -48.37 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.706 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.708 HD22 HD13 ' B' ' 3' ' ' LEU . 28.4 mt -73.82 -42.5 60.82 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 176.228 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.07 -38.58 79.11 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 113.368 -1.742 . . . . 0.0 107.442 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.683 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 2.2 t0 -48.72 -33.8 10.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.014 -1.448 . . . . 0.0 110.198 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.039 HD21 HD13 ' B' ' 34' ' ' LEU . 54.1 mt -69.2 16.67 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -76.23 -61.61 1.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.173 -0.329 . . . . 0.0 110.367 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -83.72 -17.57 40.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.927 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.745 ' CE ' HD23 ' A' ' 15' ' ' LEU . 10.8 mtm -83.01 -28.47 29.64 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.363 0.125 . . . . 0.0 111.294 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.874 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -98.04 -64.13 1.07 Allowed 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -55.45 -63.86 1.03 Allowed 'General case' 0 CA--C 1.512 -0.516 0 CA-C-O 120.83 0.347 . . . . 0.0 111.774 -178.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.62 -34.49 11.76 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.371 179.224 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -74.1 -28.26 61.27 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.673 179.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.93 -13.47 59.03 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.544 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.874 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -88.17 -174.27 4.59 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.778 0.323 . . . . 0.0 111.737 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 t -116.43 174.17 6.21 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.18 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.477 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -43.58 -38.63 3.07 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -179.179 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.689 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 1.5 m -76.96 -60.36 2.39 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.567 0.347 . . . . 0.0 111.458 -179.126 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.0 mt-10 -58.84 -17.53 24.64 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.995 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.7 tpt -75.94 -47.7 24.11 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 122.757 1.265 . . . . 0.0 108.471 177.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.802 HD13 HD21 ' B' ' 34' ' ' LEU . 0.5 OUTLIER -74.0 -35.72 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 112.7 -2.046 . . . . 0.0 113.214 -177.213 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.421 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.92 -45.85 76.65 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 122.003 0.906 . . . . 0.0 108.882 176.932 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.503 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -58.91 -41.32 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.575 0 CA-C-N 113.387 -1.733 . . . . 0.0 110.282 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.627 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -52.69 -38.27 60.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.99 178.013 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.581 HD12 ' HB ' ' B' ' 11' ' ' THR . 17.8 mt -71.66 -30.41 65.68 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.074 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -79.79 -17.19 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.387 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.56 24.4 4.75 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.71 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -77.51 125.09 28.78 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.72 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.092 -0.956 . . . . 0.0 111.343 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.686 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -88.97 134.76 33.86 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.708 HD13 HD22 ' A' ' 12' ' ' LEU . 2.7 tp -129.34 142.51 50.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.606 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.891 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -125.85 127.5 46.16 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.368 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.462 ' C ' HD12 ' B' ' 5' ' ' ILE . 2.4 pp -154.37 169.56 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.689 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 66.5 t-105 -80.88 113.92 19.41 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.409 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 15.1 tp -144.96 102.26 3.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -178.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.742 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 14.0 p -79.29 178.08 8.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -176.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ASP . . . . . 0.425 ' HB2' ' NH2' ' A' ' 1' ' ' ARG . 9.3 t70 -51.74 -50.63 60.23 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 113.093 -1.867 . . . . 0.0 112.497 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -47.74 -27.82 2.17 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.657 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 22.2 p -100.32 -22.78 14.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' B' ' 8' ' ' SER . 31.2 mt -79.21 -42.3 26.33 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 178.429 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.498 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.0 mt-10 -62.04 -41.72 98.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.033 -1.439 . . . . 0.0 107.507 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.657 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.75 -45.4 58.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.325 -1.307 . . . . 0.0 109.699 178.171 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.041 HD13 ' HG2' ' B' ' 18' ' ' MET . 1.2 mm? -82.53 22.2 0.89 Allowed 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.655 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.2 OUTLIER -80.34 -47.93 13.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.819 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.655 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 24.3 mtpp -102.92 -10.81 18.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.837 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' MET . . . . . 1.041 ' HG2' HD13 ' B' ' 15' ' ' LEU . 0.1 OUTLIER -105.86 4.64 29.92 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.027 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.852 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -99.76 -15.22 18.54 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.883 -0.51 . . . . 0.0 112.367 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 -77.89 -97.9 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.61 -27.63 62.92 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.922 0.391 . . . . 0.0 110.59 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' B' ' 18' ' ' MET . 24.4 mm-40 -101.95 -21.12 14.58 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 1.028 ' C ' HD13 ' B' ' 24' ' ' LEU . . . -102.51 -20.59 11.73 Favored Glycine 0 N--CA 1.467 0.706 0 C-N-CA 119.907 -1.14 . . . . 0.0 113.09 -179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 1.028 HD13 ' C ' ' B' ' 23' ' ' GLY . 0.0 OUTLIER 44.84 27.96 0.31 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 179.146 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 25' ' ' SER . . . . . 0.738 ' HB2' ' HB2' ' B' ' 28' ' ' GLU . 0.5 OUTLIER 132.1 142.06 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 127.659 2.384 . . . . 0.0 109.449 177.947 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -45.84 -50.8 13.85 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 117.676 0.216 . . . . 0.0 111.206 -178.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.546 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 73.4 p -81.43 -35.71 30.31 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.594 0.235 . . . . 0.0 110.869 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.881 ' HB3' ' CD2' ' B' ' 24' ' ' LEU . 13.4 mm-40 -61.72 -26.93 68.36 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.035 179.02 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 29' ' ' MET . . . . . 1.038 ' HE3' HD11 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -68.12 -38.18 81.96 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-O 122.534 1.159 . . . . 0.0 109.263 178.52 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.68 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -80.17 -30.66 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.5 0 CA-C-N 112.999 -1.909 . . . . 0.0 112.837 -175.363 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -44.8 86.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.81 HG21 HD11 ' B' ' 24' ' ' LEU . 2.1 t -58.41 -48.34 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.375 0 CA-C-N 112.422 -2.172 . . . . 0.0 111.854 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.599 ' HB1' ' HB1' ' A' ' 33' ' ' ALA . . . -47.14 -40.57 15.94 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.557 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.039 HD13 HD21 ' A' ' 15' ' ' LEU . 12.3 mt -75.73 -32.11 59.89 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.157 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -78.47 -15.15 58.94 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 25.9 m80 -122.28 6.15 9.67 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.514 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 0.5 OUTLIER -64.7 139.31 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.688 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 123.396 0.678 . . . . 0.0 112.368 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 1.2 ttt-85 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -73.18 123.36 23.49 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 178.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.818 HD22 HD22 ' B' ' 12' ' ' LEU . 2.2 tp -131.01 149.32 52.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.791 -178.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.941 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -118.33 132.32 56.28 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.995 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.848 ' CD1' HG21 ' B' ' 30' ' ' ILE . 3.6 pt -147.53 176.54 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.642 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.2 t-105 -96.57 103.59 15.51 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -177.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.715 HD11 ' CG2' ' B' ' 30' ' ' ILE . 0.7 OUTLIER -131.86 113.63 13.7 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.636 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.689 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 12.6 p -79.17 -176.85 5.35 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.727 0.775 . . . . 0.0 112.707 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -47.16 -60.42 2.49 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.369 -1.287 . . . . 0.0 112.552 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -50.61 -25.88 4.7 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.575 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 23.6 p -94.21 -34.08 13.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.7 mt -65.43 -41.13 93.84 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.42 -43.95 97.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 113.846 -1.524 . . . . 0.0 108.508 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.575 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -55.23 -50.05 70.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.491 179.081 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.003 HD21 HD13 ' B' ' 34' ' ' LEU . 14.2 mt -75.07 17.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 10.3 mm-40 -115.31 -56.35 2.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.1 mttp -76.23 -31.64 58.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.042 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.738 ' HE2' ' CD2' ' A' ' 15' ' ' LEU . 0.7 OUTLIER -97.88 21.12 11.01 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.184 0.516 . . . . 0.0 111.425 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.686 ' HA ' HD21 ' A' ' 24' ' ' LEU . . . -110.97 -64.72 1.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.472 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -54.38 -68.48 0.18 Allowed 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.162 0.506 . . . . 0.0 111.542 179.054 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -34.39 26.86 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.515 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 18' ' ' MET . 14.0 mm-40 -76.06 -27.36 57.22 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.938 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.419 ' O ' ' HB3' ' A' ' 24' ' ' LEU . . . 111.0 49.31 0.68 Allowed Glycine 0 C--N 1.34 0.758 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.29 179.216 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.716 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER 179.87 -175.88 0.3 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.567 0.699 . . . . 0.0 112.316 178.632 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.513 ' N ' HD23 ' A' ' 24' ' ' LEU . 3.3 t -117.65 -179.42 3.73 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.559 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -45.06 -38.2 4.78 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.506 ' O ' HD11 ' B' ' 7' ' ' LEU . 12.0 m -78.01 -62.57 1.63 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.716 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 4.4 mt-10 -59.99 -14.49 16.35 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.902 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.1 tpt -78.44 -47.12 18.16 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 123.791 1.758 . . . . 0.0 107.115 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.047 HG22 HD11 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -64.84 -20.81 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.69 0 CA-C-N 113.065 -1.879 . . . . 0.0 112.19 -179.131 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.39 -52.52 7.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.862 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -52.05 -33.21 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.848 0 CA-C-O 121.462 0.649 . . . . 0.0 110.395 178.525 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.88 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.2 -43.01 0.33 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.822 -1.535 . . . . 0.0 111.059 178.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.663 HD13 ' CD2' ' B' ' 15' ' ' LEU . 7.1 mt -84.63 -35.2 22.83 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.425 -179.102 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' VAL . 1.6 mt-30 -69.16 -25.6 64.44 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 179.488 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.88 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 6.9 p-80 -101.15 -29.58 12.04 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.712 0.687 . . . . 0.0 112.474 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.649 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 9.1 t80 -50.68 144.07 8.67 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 117.917 -1.04 . . . . 0.0 112.251 178.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.689 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 121.034 0.445 . . . . 0.0 111.809 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 2' ' ' TRP . . . . . 0.41 ' C ' HD22 ' B' ' 3' ' ' LEU . 85.7 m95 -110.06 116.29 31.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.137 177.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.522 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.2 mm? -131.9 150.66 52.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.258 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.941 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -117.17 132.78 56.57 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.579 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.709 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.3 pt -151.52 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.61 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.2 t-105 -94.89 97.02 9.7 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -177.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 1.047 HD11 HG22 ' A' ' 30' ' ' ILE . 2.2 mm? -130.38 108.09 9.73 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 27.5 t -67.96 -125.78 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -176.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' B' ' 11' ' ' THR . 14.4 t70 -101.1 -40.12 7.35 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -176.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -72.34 39.69 0.08 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.706 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 6.5 t -162.19 -41.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.818 HD22 HD22 ' A' ' 3' ' ' LEU . 20.2 mt -74.37 -42.67 58.92 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.23 -37.78 72.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.567 -1.651 . . . . 0.0 108.151 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.706 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.2 t70 -45.38 -33.68 2.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.083 HD22 ' CG ' ' B' ' 29' ' ' MET . 41.5 mt -82.47 27.51 0.5 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -97.71 -51.63 4.03 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -82.84 -17.29 44.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.506 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.488 ' HA ' ' HB2' ' B' ' 22' ' ' GLU . 14.3 mtm -92.23 -70.19 0.71 Allowed 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.314 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.82 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -28.68 -31.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.916 1.286 . . . . 0.0 114.358 -178.138 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.46 ' N ' ' O ' ' B' ' 18' ' ' MET . 9.0 mtp-105 -67.19 -121.71 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.918 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 tpp85 -52.46 -23.96 7.08 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.915 -0.491 . . . . 0.0 111.645 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.488 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 0.8 OUTLIER -108.08 -1.65 20.25 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -177.519 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 0.82 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -151.01 20.43 0.97 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 115.623 -3.179 . . . . 0.0 117.912 -176.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.652 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.1 mp 50.26 -157.33 0.09 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 120.108 1.954 . . . . 0.0 113.254 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -64.57 162.65 15.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.681 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.44 -44.58 17.47 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.555 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 14.8 m -82.91 -47.91 11.28 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.165 0.061 . . . . 0.0 111.165 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.471 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 2.6 mt-10 -55.61 -28.31 54.51 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.372 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 29' ' ' MET . . . . . 1.083 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.9 tpt -63.61 -48.69 76.3 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.682 1.229 . . . . 0.0 109.537 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.848 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -77.54 -30.32 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.668 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.877 -176.289 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.455 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -68.51 -48.12 65.2 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.044 177.501 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.455 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.4 t -58.37 -43.85 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-N 113.314 -1.766 . . . . 0.0 110.675 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.87 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -51.34 -32.75 26.68 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.783 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.003 HD13 HD21 ' A' ' 15' ' ' LEU . 11.2 mt -83.82 -28.99 27.67 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.889 -178.258 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -74.51 -16.24 60.84 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.278 0.474 . . . . 0.0 112.278 -179.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.9 m80 -123.05 42.22 3.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.788 0.328 . . . . 0.0 111.104 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.72 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.6 OUTLIER -58.14 133.13 55.33 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.423 0.63 . . . . 0.0 112.108 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.637 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 4.2 tptt . . . . . 0 C--O 1.249 1.072 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.675 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.531 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.795 0 CA-C-O 120.688 0.28 . . . . 0.0 111.718 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -95.19 110.77 22.69 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.417 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 3.0 tp -123.39 145.54 48.69 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.513 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.963 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -117.32 134.99 54.17 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 1.039 ' CD1' HD21 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -157.15 177.68 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.57 ' O ' HD13 ' A' ' 7' ' ' LEU . 69.8 t-105 -91.34 101.04 13.73 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.039 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.4 OUTLIER -125.56 106.59 9.87 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.378 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.429 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.1 t -85.57 -137.0 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.921 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.82 -157.33 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.566 0.209 . . . . 0.0 111.566 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 35.05 43.96 0.12 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.34 0.656 . . . . 0.0 112.247 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.66 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.85 -51.21 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.598 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.453 ' N ' ' CG2' ' A' ' 11' ' ' THR . 16.5 mt -72.22 -40.58 67.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -74.98 -40.9 60.46 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.195 -1.82 . . . . 0.0 107.982 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.66 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -51.44 -27.61 10.77 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 114.625 -1.171 . . . . 0.0 109.948 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.953 HD22 ' HE3' ' A' ' 18' ' ' MET . 0.2 OUTLIER -80.8 36.19 0.38 Allowed 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 124.286 1.035 . . . . 0.0 112.927 -179.684 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -79.79 -59.15 2.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.271 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -101.98 23.42 11.51 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.953 ' HE3' HD22 ' A' ' 15' ' ' LEU . 6.5 mtm -103.85 -86.25 0.45 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.186 -0.321 . . . . 0.0 110.922 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.73 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -45.75 -44.75 14.04 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.088 0.555 . . . . 0.0 111.507 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HD2' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -64.17 -68.98 0.31 Allowed 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 120.993 0.425 . . . . 0.0 111.664 -179.735 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.08 -32.02 33.05 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.213 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 18' ' ' MET . 22.2 mm-40 -85.48 -12.48 51.72 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.285 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.04 3.52 88.26 Favored Glycine 0 C--N 1.34 0.77 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.439 -177.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.73 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 99.2 mt -81.51 175.03 10.87 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.493 0.663 . . . . 0.0 111.025 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -120.81 167.79 12.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.334 177.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.403 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 2.4 mttm -43.19 -38.61 2.57 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.063 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.722 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.1 m -84.3 -54.76 4.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.5 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.3 mm-40 -62.09 -9.87 8.61 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.191 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.871 ' SD ' HD11 ' A' ' 15' ' ' LEU . 2.5 tpt -87.22 -46.98 9.23 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.616 1.198 . . . . 0.0 108.123 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.9 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.7 OUTLIER -75.56 -34.37 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.127 0 CA-C-N 112.948 -1.933 . . . . 0.0 112.773 -177.83 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.416 HD21 HG21 ' B' ' 11' ' ' THR . 0.2 OUTLIER -65.75 -48.08 73.07 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.327 1.06 . . . . 0.0 108.905 177.524 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.2 t -60.38 -40.81 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 CA-C-N 112.932 -1.94 . . . . 0.0 111.098 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.913 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -46.33 -43.98 16.41 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.885 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.825 HD21 ' HB2' ' B' ' 33' ' ' ALA . 10.5 mt -80.11 -29.41 38.99 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.809 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -66.78 -19.06 65.67 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.33 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -120.7 43.53 2.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.121 0.486 . . . . 0.0 109.908 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.607 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 70.3 t80 -80.74 161.39 24.59 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.777 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.716 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 5.3 mmpt? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.244 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.42 0.153 . . . . 0.0 111.283 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 2' ' ' TRP . . . . . 0.516 ' C ' HD22 ' B' ' 3' ' ' LEU . 91.9 m95 -86.12 121.56 28.9 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.516 HD22 ' C ' ' B' ' 2' ' ' TRP . 2.4 mm? -138.44 153.55 48.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.301 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.963 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -113.27 129.85 56.41 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.223 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.9 ' CD1' HG21 ' A' ' 30' ' ' ILE . 3.9 pt -141.38 173.74 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.722 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 71.4 t-105 -99.43 97.71 8.71 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.854 HD21 HG13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -125.3 105.63 9.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.561 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 8.7 p -79.41 -164.36 0.63 Allowed 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 121.607 0.717 . . . . 0.0 112.207 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 9' ' ' ASP . . . . . 0.415 ' O ' ' HG3' ' B' ' 13' ' ' GLU . 15.9 m-20 -64.47 -44.23 91.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.285 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -64.06 5.68 0.23 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.723 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.2 p -125.2 -42.89 1.97 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' B' ' 8' ' ' SER . 25.5 mt -68.86 -40.81 79.1 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.1 mt-10 -66.33 -40.27 89.78 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.144 176.362 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.723 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.09 -36.7 30.49 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.836 178.574 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.169 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.35 31.19 0.34 Allowed 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.298 -179.492 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.474 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 4.5 pt-20 -79.52 -46.41 17.44 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.416 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 3.7 ptpp? -108.36 -4.8 17.1 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.699 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.663 ' HB2' HD13 ' B' ' 15' ' ' LEU . 22.1 mtp -83.89 -74.23 0.38 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.898 0.317 . . . . 0.0 111.812 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.977 ' HB2' HD12 ' B' ' 15' ' ' LEU . . . -26.61 -33.87 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.789 1.636 . . . . 0.0 114.015 -177.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' B' ' 18' ' ' MET . 8.7 mtp-105 -66.9 -114.13 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.193 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -58.92 -21.35 57.66 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.576 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 2.4 mt-10 -113.0 -5.86 13.77 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 0.775 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -143.92 16.55 2.17 Favored Glycine 0 CA--C 1.502 -0.72 0 C-N-CA 116.442 -2.79 . . . . 0.0 116.719 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.631 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.2 mp 52.74 -162.51 0.09 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 119.271 1.536 . . . . 0.0 112.926 176.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.8 m -62.48 157.69 19.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.102 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -40.42 23.49 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 117.594 0.179 . . . . 0.0 111.149 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -77.55 -50.34 12.78 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.619 0.247 . . . . 0.0 110.558 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.482 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 0.8 OUTLIER -58.19 -30.91 66.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.278 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 29' ' ' MET . . . . . 1.169 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.3 tpt -63.4 -46.13 87.83 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 123.854 1.787 . . . . 0.0 108.752 177.404 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.952 HG22 HD11 ' A' ' 7' ' ' LEU . 0.4 OUTLIER -67.65 -15.96 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.151 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.998 -177.385 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.54 -47.43 12.16 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 176.316 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.823 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -57.79 -32.88 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.212 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.656 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 1.046 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.17 -43.91 1.13 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 113.899 -1.5 . . . . 0.0 110.884 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.941 HD13 ' CD2' ' A' ' 15' ' ' LEU . 8.8 mt -80.64 -31.05 36.62 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.437 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' B' ' 32' ' ' VAL . 29.4 mt-30 -87.14 -12.8 45.94 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 1.046 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -118.34 6.39 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 179.526 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.74 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -78.28 141.83 38.24 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.901 0.48 . . . . 0.0 110.468 179.547 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.461 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.903 -1.046 . . . . 0.0 112.039 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.531 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -72.4 124.35 24.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.895 HD22 HD22 ' B' ' 12' ' ' LEU . 1.4 tp -131.27 149.41 52.58 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.745 -178.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -117.95 128.47 54.83 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.933 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.6 pt -145.35 173.91 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.48 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 75.1 t-105 -98.83 108.99 21.82 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.73 HD11 HD12 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -124.94 121.38 34.3 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.709 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.854 ' C ' HD23 ' A' ' 12' ' ' LEU . 15.6 p -80.84 178.73 8.2 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-O 121.704 0.764 . . . . 0.0 110.885 -179.292 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -59.63 -43.26 93.9 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.932 -178.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -78.25 40.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 111.642 -179.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.729 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 10.3 t -174.75 -51.73 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.961 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.913 HD22 ' HB2' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -58.52 -30.41 67.04 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.33 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -92.88 -37.1 12.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.042 -1.436 . . . . 0.0 109.216 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.729 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.3 t70 -45.41 -35.32 3.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.517 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.033 HD21 HD13 ' B' ' 34' ' ' LEU . 45.6 mt -58.12 -11.31 2.46 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.24 -61.51 1.98 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 5.4 mmtm -63.65 -21.53 66.43 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.726 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.879 ' SD ' HD23 ' A' ' 15' ' ' LEU . 7.0 mtp -83.89 -76.42 0.29 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.01 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.704 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.89 -43.06 2.93 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.028 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 mtp85 -65.18 -70.3 0.24 Allowed 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 6.1 mmm180 -52.78 -31.74 40.11 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.134 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -83.91 -10.77 57.73 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.842 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.5 5.99 79.51 Favored Glycine 0 C--N 1.341 0.818 0 C-N-CA 120.431 -0.89 . . . . 0.0 111.701 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.704 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 97.8 mt -83.02 171.51 13.73 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.583 0.706 . . . . 0.0 111.248 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -114.84 166.73 11.45 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.425 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.64 -39.09 3.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 p -84.09 -52.92 5.9 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.482 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.5 mm-40 -62.48 -11.29 15.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.45 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.849 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.3 tpt -87.69 -48.28 7.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.41 1.576 . . . . 0.0 107.324 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.937 HG22 HD11 ' B' ' 7' ' ' LEU . 0.6 OUTLIER -68.08 -24.09 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.555 0 CA-C-N 113.571 -1.65 . . . . 0.0 112.143 -179.071 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.17 -46.4 28.7 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 177.155 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.837 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -57.43 -36.09 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.975 0 CA-C-O 121.57 0.7 . . . . 0.0 109.658 178.397 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.912 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -37.04 -47.27 0.72 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.193 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.073 HD13 HD21 ' B' ' 15' ' ' LEU . 7.8 mt -83.36 -28.86 28.68 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.967 -178.232 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -86.64 -10.56 53.57 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.912 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -128.96 15.94 6.28 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.649 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -81.89 142.51 32.43 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.118 0.567 . . . . 0.0 109.54 178.505 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.463 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.164 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.881 178.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.913 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 2' ' ' TRP . . . . . 0.409 ' C ' HD22 ' B' ' 3' ' ' LEU . 95.6 m95 -87.83 116.73 26.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.53 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -132.34 155.82 47.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.549 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -122.23 130.66 53.39 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.569 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.764 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.4 pt -150.63 -178.27 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.476 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.7 t-105 -94.6 93.26 7.48 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -177.036 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.937 HD11 HG22 ' A' ' 30' ' ' ILE . 1.6 mm? -125.12 110.76 14.52 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.576 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 25.7 t -68.35 -126.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -103.63 -41.04 6.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -72.35 41.42 0.09 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.847 0.459 . . . . 0.0 111.95 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.701 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 6.6 t -163.44 -43.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.895 HD22 HD22 ' A' ' 3' ' ' LEU . 22.8 mt -72.65 -41.65 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.43 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.1 mt-10 -74.23 -36.04 63.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.346 -1.752 . . . . 0.0 108.541 176.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.701 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.3 t70 -46.72 -36.45 7.19 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.496 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.073 HD21 HD13 ' A' ' 34' ' ' LEU . 47.5 mt -71.51 -2.75 17.9 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.43 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.6 OUTLIER -72.3 -36.99 69.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.922 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -91.79 -9.68 42.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.426 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.701 ' HE2' ' HB3' ' A' ' 34' ' ' LEU . 6.6 mtm -100.42 -76.46 0.55 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.105 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.668 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -41.09 -44.36 2.45 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 122.595 0.358 . . . . 0.0 111.4 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.498 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.6 mmm180 -64.03 -68.57 0.34 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.028 0.442 . . . . 0.0 111.901 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -52.6 -29.68 27.21 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.252 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -90.55 -8.56 49.93 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.43 7.61 73.56 Favored Glycine 0 C--N 1.342 0.871 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.897 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.668 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.0 mt -85.67 172.88 10.53 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.525 0.679 . . . . 0.0 111.42 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -110.25 165.06 12.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.482 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.9 -41.97 12.07 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.48 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 74.6 m -84.84 -48.19 9.6 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.717 0.266 . . . . 0.0 111.717 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -64.81 -10.29 26.9 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.596 0.236 . . . . 0.0 111.223 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' MET . . . . . 1.072 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.8 tpt -85.89 -47.51 9.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.933 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -73.54 -35.15 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.065 0 CA-C-N 113.092 -1.867 . . . . 0.0 113.151 -178.527 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.586 HD21 HG21 ' A' ' 11' ' ' THR . 0.2 OUTLIER -65.67 -47.2 76.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.384 1.088 . . . . 0.0 109.165 177.811 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 1.5 t -59.49 -45.23 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.051 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.885 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.61 -37.2 12.09 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.764 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.033 HD13 HD21 ' A' ' 15' ' ' LEU . 10.9 mt -81.43 -27.86 34.51 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -81.28 -13.67 58.21 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -178.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -117.46 29.67 7.74 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 118.002 0.365 . . . . 0.0 111.865 178.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.525 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 24.0 t80 -124.16 157.55 34.45 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.792 0.329 . . . . 0.0 111.649 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.464 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.016 -0.992 . . . . 0.0 112.164 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 120.367 0.127 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -82.83 120.89 26.22 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.5 mm? -131.18 151.39 51.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.625 -178.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.928 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -128.59 123.86 34.42 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.501 178.989 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.954 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.0 pt -146.76 176.18 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -178.354 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.623 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.9 t-105 -95.65 102.46 14.26 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -177.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.829 HD11 HG22 ' B' ' 30' ' ' ILE . 0.9 OUTLIER -129.63 112.08 13.33 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.839 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.571 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 11.2 p -79.65 -178.27 6.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.895 0.855 . . . . 0.0 112.697 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -49.6 -56.43 10.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.8 -1.546 . . . . 0.0 113.036 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -44.96 -33.81 2.16 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.912 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t -96.87 -22.23 17.02 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 8' ' ' SER . 66.2 mt -73.66 -39.9 64.11 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 175.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.72 -40.17 96.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.452 175.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.912 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t0 -50.42 -45.49 55.8 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.466 177.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.941 HD21 HD13 ' B' ' 34' ' ' LEU . 19.3 mt -89.75 30.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.833 179.438 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.571 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -113.53 -50.36 2.85 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.839 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.571 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 53.6 mttm -88.66 -29.92 19.55 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.145 179.317 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.513 ' O ' ' HA3' ' A' ' 23' ' ' GLY . 1.1 ptt? -99.13 15.94 24.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.682 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.879 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -99.57 -18.73 17.22 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 -67.29 -127.1 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.831 0 O-C-N 121.428 -0.795 . . . . 0.0 110.107 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.511 ' HA ' ' NE ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -52.96 -22.0 5.09 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 121.747 -0.596 . . . . 0.0 110.546 178.718 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -94.25 -21.48 19.01 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.879 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -138.54 16.47 3.34 Favored Glycine 0 CA--C 1.504 -0.609 0 C-N-CA 117.36 -2.352 . . . . 0.0 116.261 -177.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.72 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER 53.93 -167.4 0.07 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.645 1.222 . . . . 0.0 114.214 175.837 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -55.81 152.86 9.14 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.002 -1.454 . . . . 0.0 110.602 179.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -41.79 2.95 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 120.571 0.224 . . . . 0.0 111.208 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.613 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.1 m -76.64 -51.38 11.67 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.568 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.4 mt-10 -54.53 -35.74 63.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.693 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.901 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -59.36 -45.58 91.01 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.802 1.763 . . . . 0.0 108.845 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.002 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -66.36 -20.79 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.711 0 CA-C-N 112.953 -1.931 . . . . 0.0 112.713 -177.998 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.552 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -80.39 -47.76 13.93 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.348 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.83 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -58.74 -32.08 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.095 0 CA-C-O 121.681 0.753 . . . . 0.0 109.138 178.468 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 1.055 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.1 -47.15 1.51 Allowed 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 113.741 -1.572 . . . . 0.0 111.225 178.015 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.093 HD13 HD21 ' B' ' 15' ' ' LEU . 9.3 mt -81.53 -25.02 36.26 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.74 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.433 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -91.78 -8.62 46.24 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 1.055 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -125.78 16.31 8.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.732 0.413 . . . . 0.0 111.965 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.778 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -87.9 137.53 32.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.118 0.567 . . . . 0.0 111.686 -179.194 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.601 -0.714 . . . . 0.0 111.324 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -81.43 120.48 25.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' B' ' 3' ' ' LEU . 2.8 mm? -128.45 145.17 51.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.659 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.928 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -124.4 123.16 39.56 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.484 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.897 ' CD1' HG21 ' A' ' 30' ' ' ILE . 2.6 pt -147.76 -179.35 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.101 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.614 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.1 t-105 -98.98 102.51 14.26 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -176.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 1.002 HD11 HG22 ' A' ' 30' ' ' ILE . 1.8 mm? -129.44 109.56 11.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 13.2 t -78.23 -132.5 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' ASP . . . . . 0.86 ' O ' HG22 ' B' ' 11' ' ' THR . 0.8 OUTLIER -90.7 -155.52 0.39 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.575 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 10' ' ' GLN . . . . . 0.457 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.8 mm-40 37.73 45.71 0.67 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.579 0.751 . . . . 0.0 112.637 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.86 HG22 ' O ' ' B' ' 9' ' ' ASP . 9.3 t -179.17 -47.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.936 178.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.495 HD11 ' O ' ' B' ' 7' ' ' LEU . 38.4 mt -69.17 -40.3 78.21 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -68.98 -39.12 79.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.275 176.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.732 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 3.2 t70 -47.96 -33.67 8.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.539 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.093 HD21 HD13 ' A' ' 34' ' ' LEU . 57.9 mt -64.68 -5.3 5.43 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.47 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 14.5 mt-10 -62.4 -55.87 23.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.228 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.3 pttm -79.78 1.11 27.98 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.154 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' MET . . . . . 1.013 ' HE2' HD23 ' B' ' 15' ' ' LEU . 12.0 mtm -107.43 -83.11 0.54 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 111.609 0.226 . . . . 0.0 111.609 -179.154 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.744 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -43.53 -43.61 5.6 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 16.6 mtp85 -70.2 -66.0 0.65 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.976 0.417 . . . . 0.0 111.461 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.26 -32.45 37.27 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.283 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' B' ' 18' ' ' MET . 21.9 mm-40 -88.44 -10.54 48.8 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.295 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.86 7.3 80.69 Favored Glycine 0 C--N 1.339 0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.502 -178.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.744 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 96.2 mt -80.27 171.51 14.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.578 0.704 . . . . 0.0 111.408 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -112.19 165.0 12.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.404 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.6 -40.0 5.43 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.0 m -83.32 -52.23 6.74 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.428 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.2 mt-10 -63.79 -11.04 23.36 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.756 -0.202 . . . . 0.0 110.958 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.983 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.0 tpt -85.16 -47.05 10.51 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 122.742 1.258 . . . . 0.0 107.704 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.954 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.6 OUTLIER -75.13 -32.59 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.04 0 CA-C-N 112.889 -1.959 . . . . 0.0 113.216 -178.008 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.32 -50.45 39.07 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.121 0.962 . . . . 0.0 109.449 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.428 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.4 t -55.97 -42.9 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 113.219 -1.809 . . . . 0.0 110.264 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.941 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -49.44 -30.88 8.72 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.288 -1.323 . . . . 0.0 112.232 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.941 HD13 HD21 ' A' ' 15' ' ' LEU . 10.8 mt -89.66 -32.88 16.85 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -177.202 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -72.12 -13.45 61.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -116.52 40.84 2.8 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.632 ' HD1' ' CE1' ' A' ' 36' ' ' HIS . 63.0 t80 -83.5 163.73 20.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.9 -178.479 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.563 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.282 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.846 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.063 0.459 . . . . 0.0 111.757 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -105.01 113.79 27.6 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.4 tp -122.71 142.57 50.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.944 -178.257 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.841 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -123.68 129.58 51.34 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.121 178.486 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.76 HD11 HG21 ' B' ' 30' ' ' ILE . 2.1 pt -148.67 179.22 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.407 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.422 ' O ' ' HB3' ' B' ' 27' ' ' SER . 71.1 t-105 -96.2 90.41 5.48 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.736 HD21 ' CD1' ' A' ' 5' ' ' ILE . 1.9 mm? -119.16 101.26 7.87 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.512 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.46 ' HA ' ' HB2' ' B' ' 1' ' ' ARG . 51.6 p -74.76 -135.2 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.187 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.44 -156.68 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.338 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 34.32 43.68 0.09 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.355 0.662 . . . . 0.0 112.465 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.704 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -172.19 -48.88 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.932 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 7' ' ' LEU . 15.3 mt -75.85 -41.25 52.96 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -77.17 -39.99 46.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.317 176.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.704 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -51.05 -24.75 4.09 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.078 178.549 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.199 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -77.45 41.96 0.33 Allowed 'General case' 0 N--CA 1.424 -1.767 0 C-N-CA 124.24 1.016 . . . . 0.0 112.637 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.687 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -91.15 -47.91 7.26 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.342 179.926 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.687 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 5.3 mtpm? -102.88 24.8 10.14 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.212 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.638 ' HB2' HD13 ' A' ' 15' ' ' LEU . 16.6 mtp -116.51 -86.05 0.62 Allowed 'General case' 0 C--O 1.223 -0.34 0 O-C-N 122.172 -0.33 . . . . 0.0 111.201 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.708 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -42.0 -45.43 3.85 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.133 0.573 . . . . 0.0 111.188 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HD2' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -65.79 -67.18 0.46 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.147 0.498 . . . . 0.0 111.476 179.78 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.59 -32.76 29.86 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.154 179.332 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -86.18 -12.94 48.47 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.299 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.1 4.64 88.93 Favored Glycine 0 C--N 1.339 0.723 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.628 -178.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.708 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 98.4 mt -82.01 171.74 14.05 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.579 0.704 . . . . 0.0 111.36 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -116.96 168.6 10.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.371 177.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.437 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -45.41 -37.89 5.5 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.066 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.437 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 58.8 m -80.39 -57.39 3.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.442 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HB3' HD22 ' A' ' 24' ' ' LEU . 1.8 mm-40 -60.75 -16.21 37.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.137 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' MET . . . . . 1.199 ' SD ' HD11 ' A' ' 15' ' ' LEU . 2.4 tpt -82.15 -45.61 14.92 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-O 123.704 1.716 . . . . 0.0 107.853 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.807 HG21 HG12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -66.2 -19.48 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.99 0 CA-C-N 113.355 -1.748 . . . . 0.0 111.615 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.439 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -78.1 -53.29 7.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.91 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -51.69 -32.51 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.711 0 CA-C-O 121.584 0.707 . . . . 0.0 109.548 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.872 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -40.05 -43.39 1.57 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.93 -1.486 . . . . 0.0 111.064 177.552 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.897 HD22 HD21 ' B' ' 15' ' ' LEU . 6.8 mt -80.67 -29.08 36.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.824 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' A' ' 32' ' ' VAL . 44.9 mt-30 -79.08 -30.69 44.03 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.872 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 22.1 p80 -92.05 -35.67 13.8 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 119.049 0.841 . . . . 0.0 111.895 178.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.67 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 8.1 t80 -46.53 140.44 4.34 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.607 0.242 . . . . 0.0 111.179 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.468 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 117.972 -1.013 . . . . 0.0 112.108 178.03 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.46 ' HB2' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.384 0.135 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -82.32 119.45 24.14 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -126.37 134.25 51.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.525 -178.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.841 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -112.25 131.01 55.73 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.032 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.807 HG12 HG21 ' A' ' 30' ' ' ILE . 2.5 pp -153.73 169.98 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.581 ' O ' HD12 ' B' ' 7' ' ' LEU . 73.7 t-105 -89.04 100.44 13.22 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -178.086 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.802 HD13 HD13 ' B' ' 5' ' ' ILE . 1.9 mp -135.17 114.66 12.56 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.846 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -91.93 -169.86 2.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.095 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -43.41 -60.09 1.86 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.126 -1.397 . . . . 0.0 112.869 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.58 -24.72 0.94 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.642 ' HB ' HD12 ' A' ' 34' ' ' LEU . 20.4 p -103.34 -27.41 12.47 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' B' ' 8' ' ' SER . 35.7 mt -74.22 -40.57 62.36 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -62.73 -41.04 98.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.34 176.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.616 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -48.91 -40.41 29.88 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.522 179.132 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.032 HD22 ' CG ' ' B' ' 29' ' ' MET . 26.3 mt -78.83 32.34 0.2 Allowed 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 44.9 mt-10 -103.1 -55.09 2.48 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.468 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 50.2 mttp -81.49 -25.15 36.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.433 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.837 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 9.5 mtm -86.2 -21.91 27.23 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.3 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.718 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.95 -68.4 0.83 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.828 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -57.8 -66.38 0.48 Allowed 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.011 0.434 . . . . 0.0 112.067 -179.599 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 21' ' ' ARG . . . . . 0.468 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -49.53 -34.18 16.72 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.368 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.52 ' HB2' ' O ' ' B' ' 18' ' ' MET . 20.2 mm-40 -85.08 -10.7 56.59 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.243 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.03 -7.47 81.26 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.752 -178.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.718 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 73.8 mt -74.53 173.83 9.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.606 0.717 . . . . 0.0 111.596 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.3 p -119.05 166.01 13.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.582 178.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.67 -39.67 3.73 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' TRP . 1.4 m -84.14 -54.07 5.08 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 121.961 0.104 . . . . 0.0 111.19 -179.72 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.03 -8.79 5.8 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.648 0.261 . . . . 0.0 111.113 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' MET . . . . . 1.032 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.5 tpt -85.91 -47.96 9.16 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.76 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -75.63 -30.92 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.995 0 CA-C-N 113.003 -1.908 . . . . 0.0 113.283 -177.726 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.456 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -69.97 -49.83 47.84 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.263 1.03 . . . . 0.0 109.297 177.629 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.34 -43.13 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.082 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.736 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -46.23 -41.9 13.52 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.563 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.738 HD21 ' HB2' ' A' ' 33' ' ' ALA . 8.5 mt -80.25 -28.62 38.42 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.157 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -70.62 -17.65 62.88 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -119.39 42.98 2.73 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.046 0.45 . . . . 0.0 110.903 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.5 ' HD1' ' CE1' ' A' ' 36' ' ' HIS . 69.6 t80 -55.95 172.63 0.18 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.645 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.429 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.155 0 C-N-CA 123.569 0.748 . . . . 0.0 111.961 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.655 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 120.93 0.395 . . . . 0.0 111.825 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 76.1 m95 -114.91 107.29 15.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.582 177.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -122.15 140.67 52.27 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.294 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -106.94 135.36 48.63 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.486 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.875 HD12 HD21 ' A' ' 7' ' ' LEU . 1.1 pt -151.65 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.602 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.3 t-105 -95.12 89.37 5.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.875 HD21 HD12 ' A' ' 5' ' ' ILE . 1.6 mm? -129.24 100.94 5.78 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.592 ' O ' HG22 ' A' ' 11' ' ' THR . 12.7 p -69.67 -171.55 0.4 Allowed 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 122.028 0.918 . . . . 0.0 112.651 -177.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.31 -39.16 82.16 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.209 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.636 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 31.2 mt-30 -75.63 42.19 0.22 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.679 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.676 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 1.3 t -169.3 -31.87 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.85 HD22 HD22 ' B' ' 3' ' ' LEU . 16.7 mt -82.77 -43.08 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 177.14 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.9 -29.19 18.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.554 -1.657 . . . . 0.0 110.015 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.676 ' HB2' ' N ' ' A' ' 11' ' ' THR . 14.4 t70 -46.46 -13.58 0.02 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.709 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.014 HD11 HD13 ' B' ' 34' ' ' LEU . 0.0 OUTLIER -140.14 46.45 1.84 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 179.224 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 6.3 mt-10 -49.67 -28.61 6.13 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 178.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 21' ' ' ARG . 4.1 mtmp? -71.8 -48.12 48.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.989 ' HE3' ' HG ' ' A' ' 15' ' ' LEU . 16.0 mtm -59.08 -28.75 66.77 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.698 0.285 . . . . 0.0 111.331 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.77 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -98.79 -60.32 1.56 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.0 mtp85 -70.56 -68.07 0.45 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.015 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.515 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 13.2 mmp_? -50.23 -31.61 14.43 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.852 -179.671 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.59 ' HB2' ' O ' ' A' ' 18' ' ' MET . 19.6 mm-40 -85.5 -15.38 43.02 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.954 179.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.11 -1.95 85.08 Favored Glycine 0 C--N 1.339 0.749 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.783 -178.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.892 HD12 ' O ' ' A' ' 18' ' ' MET . 82.9 mt -73.97 178.4 4.98 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.686 0.755 . . . . 0.0 111.512 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' A' ' 29' ' ' MET . 52.2 p -117.43 165.47 13.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.025 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 mttm -47.7 -37.88 13.99 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.585 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.2 m -85.55 -50.81 6.94 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.16 -11.32 8.56 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.939 0.149 . . . . 0.0 111.055 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.829 ' HG2' HD21 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -84.27 -42.31 15.99 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.029 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.772 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -77.28 -39.63 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.254 0 CA-C-N 112.901 -1.954 . . . . 0.0 113.269 -176.974 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.432 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -58.01 -46.2 85.65 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.325 1.059 . . . . 0.0 108.337 176.914 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.432 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -58.81 -43.48 88.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.062 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.804 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -60.46 -38.13 83.21 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.796 178.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.018 HD13 HD21 ' B' ' 15' ' ' LEU . 16.7 mt -70.3 -26.68 63.9 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.181 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.521 ' HG2' ' CE1' ' A' ' 36' ' ' HIS . 0.6 OUTLIER -78.74 -30.19 45.67 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.129 -178.441 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.521 ' CE1' ' HG2' ' A' ' 35' ' ' GLN . 1.9 m80 -120.1 32.74 5.9 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.543 0.61 . . . . 0.0 111.375 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.576 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -83.26 132.21 35.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 122.476 -0.14 . . . . 0.0 110.657 179.326 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.548 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.483 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.526 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -78.81 116.63 19.27 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.85 HD22 HD22 ' A' ' 12' ' ' LEU . 1.7 tp -138.44 148.96 44.99 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.241 -178.532 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -107.04 134.93 49.44 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.399 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.828 ' CD1' HD21 ' B' ' 7' ' ' LEU . 4.3 pt -136.83 170.46 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.72 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.2 t-105 -97.11 102.33 14.08 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.828 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.4 OUTLIER -131.81 113.16 13.16 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.662 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.655 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 15.7 p -76.18 -173.9 2.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 112.025 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -48.52 -62.12 1.66 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.352 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -50.85 -28.89 10.43 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.61 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 69.3 p -88.01 -32.63 18.72 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' B' ' 8' ' ' SER . 67.9 mt -68.64 -40.45 80.29 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 177.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.85 -42.72 98.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 113.538 -1.664 . . . . 0.0 107.771 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.639 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -55.51 -46.74 76.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.092 178.589 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.028 HD22 ' CG ' ' B' ' 29' ' ' MET . 15.0 mt -73.24 25.89 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 43.5 mt-10 -111.49 -56.59 2.36 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.68 -29.57 61.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.845 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 21.4 mtm -82.99 -22.35 33.69 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.772 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.717 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.73 -69.06 0.78 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.558 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.4 mtp85 -55.53 -64.24 0.91 Allowed 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.255 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.33 -32.44 17.18 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.192 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' B' ' 18' ' ' MET . 3.8 mm-40 -89.68 -4.92 57.52 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.403 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.26 -11.02 61.83 Favored Glycine 0 C--N 1.34 0.768 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.953 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.717 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 74.8 mt -72.07 172.75 9.53 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.743 0.782 . . . . 0.0 111.685 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 89.8 p -119.87 164.28 16.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.253 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.418 ' HB3' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -43.55 -36.05 1.93 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.35 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.437 ' CB ' ' H ' ' A' ' 6' ' ' TRP . 1.4 m -83.51 -56.48 3.72 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 122.221 0.208 . . . . 0.0 111.363 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.471 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.3 mt-10 -62.48 -8.56 6.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.495 178.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 29' ' ' MET . . . . . 1.028 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.3 tpt -86.0 -48.59 8.53 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.754 HD11 HD11 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -73.08 -35.12 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.044 0 CA-C-N 112.966 -1.925 . . . . 0.0 112.976 -178.051 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.435 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -66.55 -49.41 66.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 122.021 0.915 . . . . 0.0 109.155 177.503 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -57.3 -42.33 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 113.393 -1.73 . . . . 0.0 111.932 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.806 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -48.86 -39.68 26.65 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.429 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.014 HD13 HD11 ' A' ' 15' ' ' LEU . 9.2 mt -76.65 -35.83 57.73 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.196 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -72.93 -11.12 60.46 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -106.87 -50.53 3.09 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.947 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.615 ' CD2' ' SD ' ' A' ' 18' ' ' MET . 12.0 t80 -44.12 144.58 0.92 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.264 0.352 . . . . 0.0 110.9 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.47 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.012 -0.995 . . . . 0.0 112.14 178.172 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 120.933 0.397 . . . . 0.0 111.881 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.403 ' C ' HD22 ' A' ' 3' ' ' LEU . 98.4 m95 -89.02 122.83 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.044 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.497 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 3.2 mm? -130.08 153.8 48.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.896 -178.586 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' B' ' 3' ' ' LEU . 0.5 OUTLIER -127.76 129.72 47.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.409 178.898 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.825 HD12 HD21 ' A' ' 7' ' ' LEU . 1.3 pt -148.11 -179.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.694 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.574 ' C ' HD22 ' A' ' 7' ' ' LEU . 71.7 t-105 -95.06 91.32 6.29 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -177.264 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.825 HD21 HD12 ' A' ' 5' ' ' ILE . 1.8 mm? -127.46 104.05 7.69 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.451 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.674 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 8.4 t -75.5 -137.4 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 120.557 0.218 . . . . 0.0 110.916 -178.789 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.483 ' O ' HG22 ' A' ' 11' ' ' THR . 1.9 p-10 -84.27 -155.76 0.2 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.963 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.409 ' O ' ' HB ' ' A' ' 11' ' ' THR . 2.1 tt0 36.01 43.11 0.19 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.505 0.722 . . . . 0.0 112.675 178.885 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.727 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -173.03 -45.38 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.725 178.681 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.644 HD11 ' O ' ' A' ' 7' ' ' LEU . 18.1 mt -78.37 -40.74 35.42 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 175.981 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -38.84 26.91 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 113.187 -1.824 . . . . 0.0 108.315 177.606 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.727 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -48.97 -26.47 2.54 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.009 -1.451 . . . . 0.0 110.898 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.94 HD11 ' CE ' ' A' ' 18' ' ' MET . 0.4 OUTLIER -82.13 24.29 0.66 Allowed 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.475 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -66.14 -40.3 90.52 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 122.249 -0.282 . . . . 0.0 110.259 178.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -105.78 -13.68 15.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.94 ' CE ' HD11 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -106.49 5.17 29.03 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 -179.015 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.923 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -98.76 -20.95 16.62 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 178.139 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.401 ' HB2' ' NH1' ' A' ' 20' ' ' ARG . 4.4 mtp-105 -70.42 -124.04 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 O-C-N 121.62 -0.675 . . . . 0.0 110.112 -179.332 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.2 -25.24 3.43 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.959 0.409 . . . . 0.0 110.843 179.09 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -95.64 -19.98 19.31 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -178.731 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.923 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -135.55 12.84 4.28 Favored Glycine 0 CA--C 1.504 -0.608 0 C-N-CA 117.145 -2.455 . . . . 0.0 116.489 -177.143 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.726 HD12 ' C ' ' A' ' 23' ' ' GLY . 0.6 OUTLIER 53.04 -162.91 0.1 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 118.916 1.358 . . . . 0.0 113.483 175.798 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -58.66 158.04 8.45 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.833 177.806 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.14 -40.76 5.21 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.231 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.4 ' CB ' ' H ' ' B' ' 6' ' ' TRP . 3.9 m -77.77 -49.67 13.91 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.482 0.182 . . . . 0.0 111.277 179.991 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.578 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 9.5 mt-10 -55.96 -33.58 64.91 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.353 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.856 ' SD ' ' HG ' ' A' ' 15' ' ' LEU . 5.4 tpt -59.95 -51.91 67.67 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 123.18 1.466 . . . . 0.0 108.848 177.686 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.882 HG21 HD13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -69.39 -29.81 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.587 0 CA-C-N 112.938 -1.937 . . . . 0.0 113.974 -177.265 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.44 -49.46 48.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.198 0.999 . . . . 0.0 108.882 176.706 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.491 HG21 HD11 ' A' ' 24' ' ' LEU . 1.4 t -56.33 -42.26 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.307 0 CA-C-N 113.093 -1.867 . . . . 0.0 111.434 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.895 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -48.44 -43.33 34.29 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.106 179.169 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.027 HD13 ' CD2' ' B' ' 15' ' ' LEU . 11.7 mt -70.73 -29.7 66.02 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.943 -178.141 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -76.92 -23.27 52.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.435 ' HB3' ' HB2' ' B' ' 38' ' ' LYS . 37.0 m80 -118.87 7.83 11.61 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 178.816 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.665 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.4 OUTLIER -61.96 138.05 58.32 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.168 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 117.883 -1.056 . . . . 0.0 112.334 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.674 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 2.1 ttt85 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -72.45 125.07 26.5 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.56 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.549 HD22 HD22 ' A' ' 12' ' ' LEU . 2.4 tp -126.37 141.24 51.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.732 -178.479 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.498 ' O ' HG23 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -119.82 131.8 55.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.343 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.046 ' CD1' HD21 ' B' ' 7' ' ' LEU . 1.2 pp -157.19 173.05 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 121.05 0.452 . . . . 0.0 112.142 -178.434 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.646 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.8 t-105 -88.61 109.52 20.16 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.962 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 1.046 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.4 OUTLIER -130.91 122.02 26.22 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.085 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 33.7 t -78.03 -126.57 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -178.68 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 9' ' ' ASP . . . . . 0.514 ' O ' ' HB3' ' B' ' 13' ' ' GLU . 12.4 t70 -105.06 -44.05 4.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.195 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.42 39.82 0.1 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.118 0.485 . . . . 0.0 111.618 -179.412 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.744 ' OG1' HD12 ' A' ' 34' ' ' LEU . 5.1 t -159.5 -41.34 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 179.76 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.929 HD21 ' HB2' ' B' ' 7' ' ' LEU . 50.3 mt -72.96 -41.86 63.99 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 176.729 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' B' ' 9' ' ' ASP . 0.1 OUTLIER -73.37 -38.29 65.74 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.196 -1.82 . . . . 0.0 107.365 176.793 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.688 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.2 t70 -47.74 -36.89 12.18 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.743 -1.571 . . . . 0.0 110.45 179.066 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.027 ' CD2' HD13 ' A' ' 34' ' ' LEU . 45.7 mt -68.71 -10.92 59.23 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -179.592 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.35 -59.62 4.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.662 0.268 . . . . 0.0 110.927 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.57 -19.04 64.45 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.91 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.734 ' CE ' HD23 ' B' ' 15' ' ' LEU . 39.1 mtm -89.98 -77.01 0.41 Allowed 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.247 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.515 ' HA ' ' OE2' ' B' ' 22' ' ' GLU . . . -37.09 -41.52 0.37 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.138 0.575 . . . . 0.0 112.324 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -68.91 -71.02 0.24 Allowed 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.847 0.356 . . . . 0.0 111.497 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -29.81 45.79 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.08 179.326 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.67 ' CD ' HD12 ' B' ' 24' ' ' LEU . 3.9 pt-20 -83.71 -15.72 47.62 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.482 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.52 12.02 84.69 Favored Glycine 0 C--N 1.344 1.008 0 C-N-CA 121.214 -0.517 . . . . 0.0 114.011 178.416 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.67 HD12 ' CD ' ' B' ' 22' ' ' GLU . 65.1 mt -102.35 175.18 5.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.553 0.692 . . . . 0.0 111.668 -179.481 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 68.5 p -106.3 164.56 11.92 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.904 -1.043 . . . . 0.0 109.749 178.502 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.05 -39.04 1.12 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.352 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.526 ' O ' HD11 ' A' ' 7' ' ' LEU . 1.2 m -81.15 -59.44 2.65 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 122.028 0.131 . . . . 0.0 111.3 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -57.76 -14.87 6.5 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.726 0.298 . . . . 0.0 110.922 179.036 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.98 ' CG ' HD22 ' B' ' 15' ' ' LEU . 1.7 tpt -78.41 -46.28 20.26 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 122.73 1.252 . . . . 0.0 107.996 177.743 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.903 HD11 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.45 -29.7 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.109 0 CA-C-N 112.918 -1.946 . . . . 0.0 113.66 -177.605 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.528 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -70.26 -49.99 44.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.325 1.059 . . . . 0.0 109.009 177.329 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -56.71 -43.73 79.92 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 CA-C-N 112.958 -1.928 . . . . 0.0 110.967 -179.378 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.758 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -45.54 -39.34 7.34 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.341 179.072 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.895 HD23 ' CB ' ' A' ' 33' ' ' ALA . 8.8 mt -75.97 -32.25 59.4 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.167 -177.938 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -79.92 -11.41 59.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -125.49 36.96 4.46 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.255 0.55 . . . . 0.0 111.05 177.573 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.742 ' HD1' ' N ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -58.37 130.08 45.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.362 178.86 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.742 ' N ' ' HD1' ' B' ' 37' ' ' TYR . 7.1 mmpt? . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.58 176.051 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.779 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.803 0.335 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.446 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.2 m95 -79.01 166.99 21.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.2 tp -176.76 145.49 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.099 -179.49 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.717 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -102.27 140.42 36.58 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.616 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.955 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.4 pt -148.47 175.46 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.268 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.679 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 75.4 t-105 -101.15 105.75 16.93 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.88 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.772 HD21 HG13 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -127.2 120.28 28.4 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.728 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 t -82.36 -129.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -178.806 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -102.77 -40.96 6.35 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.536 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.89 41.69 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.232 0.539 . . . . 0.0 111.522 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.86 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.0 t -164.41 -44.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.347 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.645 HD21 ' HB2' ' A' ' 7' ' ' LEU . 84.3 mt -63.9 -40.37 96.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.407 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -64.32 -42.13 96.46 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.429 -1.714 . . . . 0.0 108.132 176.403 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.86 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.3 OUTLIER -51.38 -41.33 60.61 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.356 178.244 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.006 HD21 HD13 ' B' ' 34' ' ' LEU . 24.6 mt -83.96 32.72 0.48 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.98 179.789 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -107.57 -69.35 0.85 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? -76.99 -25.69 53.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.405 179.079 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.615 ' HE1' ' HB3' ' B' ' 34' ' ' LEU . 0.9 OUTLIER -94.52 8.02 43.6 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.54 179.796 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.882 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -100.29 -17.97 17.04 Favored 'General case' 0 C--O 1.214 -0.785 0 C-N-CA 122.954 0.502 . . . . 0.0 112.199 178.894 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -131.13 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.814 0 O-C-N 121.592 -0.693 . . . . 0.0 109.866 -179.899 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -23.54 1.85 Allowed 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 121.8 -0.563 . . . . 0.0 110.464 178.629 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -92.17 -23.79 19.28 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -178.563 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.882 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -137.07 17.2 3.62 Favored Glycine 0 CA--C 1.504 -0.638 0 C-N-CA 117.218 -2.42 . . . . 0.0 116.529 -177.336 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.704 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER 54.62 -166.45 0.09 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 118.799 1.3 . . . . 0.0 114.147 175.654 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.06 154.11 13.37 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.516 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -42.69 8.84 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-O 120.438 0.161 . . . . 0.0 111.209 -179.685 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.659 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 5.9 m -75.65 -44.63 41.58 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.919 179.26 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.9 OUTLIER -62.4 -37.32 85.31 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.509 179.513 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.959 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -57.99 -43.52 86.62 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 124.125 1.917 . . . . 0.0 108.36 177.058 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.086 HG21 HD12 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -68.61 -16.3 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.911 0 CA-C-N 112.583 -2.099 . . . . 0.0 112.949 -177.778 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.83 -45.13 11.17 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.901 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.821 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -59.0 -31.4 45.54 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.635 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 1.032 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -38.08 -46.84 1.06 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.319 177.951 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.893 HD13 ' CD2' ' B' ' 15' ' ' LEU . 8.1 mt -82.68 -26.56 31.98 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.653 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -87.84 -13.75 41.29 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -179.789 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 1.032 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -117.9 4.09 12.18 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 179.699 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.648 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.8 t80 -76.56 146.38 38.39 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.8 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.202 179.442 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -90.7 105.1 17.59 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.732 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.45 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 1.9 tp -125.26 145.64 49.9 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.251 -177.77 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.717 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -103.27 136.91 42.17 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 177.627 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.086 HD12 HG21 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -149.53 -175.0 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.015 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.659 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 64.8 t-105 -92.62 91.0 7.35 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.396 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.975 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -125.2 95.08 4.36 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.601 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.779 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 51.2 p -64.73 177.82 0.88 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 121.761 0.791 . . . . 0.0 111.853 -178.377 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -54.19 -52.65 60.55 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.649 -179.744 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -55.68 -26.88 47.11 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -179.169 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.673 ' HB ' HD12 ' A' ' 34' ' ' LEU . 37.1 p -82.97 -30.29 28.38 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.286 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' B' ' 8' ' ' SER . 30.0 mt -73.77 -39.33 64.26 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 178.619 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.8 mt-10 -60.15 -41.29 92.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 113.719 -1.582 . . . . 0.0 107.612 175.906 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.51 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -53.21 -39.91 64.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.192 -1.367 . . . . 0.0 110.537 178.603 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.061 HD22 ' CG ' ' B' ' 29' ' ' MET . 30.9 mt -77.75 28.4 0.17 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.535 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -101.01 -49.58 4.07 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.657 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.535 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 57.0 mttm -84.61 -20.81 30.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.58 179.25 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.888 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.6 mtm -91.93 -21.04 20.79 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.612 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.698 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -102.66 -62.25 1.3 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.253 179.714 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 4.8 mtp-105 -62.21 -64.94 0.77 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.962 0.41 . . . . 0.0 111.691 -179.487 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -33.4 21.83 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.286 179.78 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.516 ' HB2' ' O ' ' B' ' 18' ' ' MET . 22.3 mm-40 -85.77 -11.57 53.19 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.292 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.1 -6.02 84.08 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.791 -178.428 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.698 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.1 mt -74.08 174.69 8.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.57 0.7 . . . . 0.0 111.529 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 23.1 p -116.95 168.88 9.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.665 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -47.52 -41.17 20.45 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.322 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.679 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 80.8 p -84.62 -49.74 8.29 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.889 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.49 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.8 mm-40 -64.35 -7.95 11.41 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.628 0.251 . . . . 0.0 110.77 178.805 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 29' ' ' MET . . . . . 1.061 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.7 tpt -85.88 -48.03 9.12 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 122.741 1.258 . . . . 0.0 107.804 177.504 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.955 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -75.89 -38.0 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.041 0 CA-C-N 112.907 -1.951 . . . . 0.0 113.189 -177.744 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -46.91 83.38 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.324 1.059 . . . . 0.0 109.092 177.967 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.49 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -61.62 -43.41 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.627 -179.104 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.905 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.89 -30.5 4.19 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.932 179.797 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.006 HD13 HD21 ' A' ' 15' ' ' LEU . 12.1 mt -90.44 -30.48 17.32 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -177.145 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.65 -17.33 62.26 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -110.99 39.06 2.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.182 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.568 ' HD2' ' CE1' ' A' ' 36' ' ' HIS . 51.0 t80 -86.08 160.02 19.4 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.792 -178.61 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.2 mppt? . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.576 178.351 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.505 ' CB ' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.934 0.397 . . . . 0.0 111.807 . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -87.23 165.07 15.96 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.697 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.655 HD22 HD22 ' B' ' 12' ' ' LEU . 2.6 tp -167.94 147.12 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.631 -179.411 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.713 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -125.26 135.77 52.87 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.969 178.97 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.929 HD12 HG21 ' B' ' 30' ' ' ILE . 0.3 OUTLIER -151.22 -174.84 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -178.724 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.78 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 67.5 t-105 -97.03 95.57 7.89 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.817 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.825 HD11 ' CG2' ' B' ' 30' ' ' ILE . 1.2 mm? -126.78 103.72 7.68 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.55 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.804 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.2 OUTLIER -95.84 -171.38 2.33 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.636 0.732 . . . . 0.0 112.661 -177.442 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -43.3 -56.44 3.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.227 -1.351 . . . . 0.0 112.367 -178.985 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -50.03 -28.51 7.14 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.159 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.696 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 19.8 p -97.39 -28.49 13.99 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.406 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 8' ' ' SER . 21.4 mt -75.49 -40.94 56.62 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 178.835 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.525 ' O ' ' HB3' ' A' ' 16' ' ' GLU . 2.9 mt-10 -65.79 -40.31 91.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 113.766 -1.561 . . . . 0.0 108.076 176.103 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.696 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -47.55 -45.29 26.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.59 179.039 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.855 HD12 ' HB2' ' A' ' 19' ' ' ALA . 3.5 mm? -77.43 16.73 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -178.542 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.57 ' CG ' ' HG2' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -74.12 -46.9 39.73 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.632 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.57 ' HG2' ' CG ' ' A' ' 16' ' ' GLU . 1.5 mmtm -96.88 1.95 51.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.612 179.029 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.733 ' HB2' HD13 ' A' ' 15' ' ' LEU . 5.0 mtm -108.06 -74.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.983 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.855 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -53.46 -50.7 64.74 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.572 0.349 . . . . 0.0 111.827 -178.911 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.07 -61.05 2.89 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.14 0.495 . . . . 0.0 110.481 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.02 -34.18 28.37 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.882 -1.053 . . . . 0.0 110.046 178.65 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -73.53 -20.17 60.72 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.485 179.099 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.05 5.04 74.49 Favored Glycine 0 C--N 1.34 0.788 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.212 -179.14 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.744 HD23 ' C ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -91.55 175.15 7.01 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.184 0.516 . . . . 0.0 111.959 -179.134 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.8 p -96.82 164.32 12.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.446 178.936 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 29' ' ' MET . 10.9 mttm -46.2 -32.14 2.84 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.763 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.626 ' HA ' HD12 ' B' ' 5' ' ' ILE . 6.7 p -77.2 -50.55 12.7 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.853 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 32' ' ' VAL . 10.8 mt-10 -55.74 -24.43 35.14 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.851 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.819 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -78.12 -42.33 32.28 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 121.925 0.869 . . . . 0.0 109.029 178.658 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.766 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -78.25 -23.15 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.477 0 CA-C-N 114.195 -1.366 . . . . 0.0 113.359 -176.699 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.465 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.2 OUTLIER -72.87 -53.34 11.67 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.749 0.785 . . . . 0.0 109.13 176.288 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.585 HG12 ' O ' ' A' ' 28' ' ' GLU . 12.7 p -61.99 -30.89 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.962 0 CA-C-N 114.128 -1.396 . . . . 0.0 112.594 -177.673 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.777 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -42.37 -37.69 1.63 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.451 177.879 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.128 HD13 HD23 ' B' ' 15' ' ' LEU . 8.4 mt -87.89 -29.37 20.92 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.837 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -69.72 -59.46 2.93 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -177.523 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.783 ' NE2' ' HB2' ' B' ' 37' ' ' TYR . 9.7 p-80 -56.93 -36.16 69.91 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 119.158 0.89 . . . . 0.0 111.973 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.739 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 10.4 t80 -42.17 145.73 0.35 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 -177.499 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.249 1.039 0 C-N-CA 124.279 1.031 . . . . 0.0 112.769 178.299 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.804 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 120.992 0.425 . . . . 0.0 111.829 . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -108.93 116.19 31.52 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 177.55 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.497 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.12 144.66 51.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.388 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.713 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.02 133.35 56.11 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.502 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 27' ' ' SER . 0.9 OUTLIER -149.59 -177.71 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.468 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -91.17 87.64 6.61 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -177.094 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.766 HD11 HG22 ' A' ' 30' ' ' ILE . 1.9 mm? -119.81 101.43 7.88 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.814 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.505 ' HA ' ' CB ' ' A' ' 1' ' ' ARG . 48.0 t -67.05 -117.69 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.67 -178.188 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.24 -147.35 0.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.266 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 10' ' ' GLN . . . . . 0.473 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.5 tm0? 34.36 44.4 0.1 Allowed 'General case' 0 C--N 1.346 0.43 0 C-N-CA 123.847 0.859 . . . . 0.0 113.202 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.669 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.0 OUTLIER -177.48 -46.5 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.436 178.971 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.655 HD22 HD22 ' A' ' 3' ' ' LEU . 27.1 mt -73.47 -40.65 63.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.789 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -76.95 -37.46 55.23 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 113.297 -1.774 . . . . 0.0 108.161 176.309 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.669 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -52.32 -20.07 2.5 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.029 178.322 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.128 HD23 HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -71.63 43.96 0.09 Allowed 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 125.172 1.389 . . . . 0.0 112.21 179.323 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -86.73 -58.72 2.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.938 179.537 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -98.02 22.57 9.19 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.261 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.786 ' HB2' HD13 ' B' ' 15' ' ' LEU . 0.5 OUTLIER -103.15 -84.68 0.46 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.663 179.75 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.579 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -49.0 -41.75 35.51 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.018 0.527 . . . . 0.0 111.185 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 mtt-85 -64.35 -67.77 0.41 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.965 0.412 . . . . 0.0 111.078 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -32.65 44.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.969 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' B' ' 18' ' ' MET . 37.8 mt-10 -82.66 -17.15 45.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.945 179.747 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.09 9.41 86.97 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -177.301 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 95.3 mt -88.62 171.48 10.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.555 0.742 . . . . 0.0 111.769 -179.445 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 87.5 p -110.53 163.34 13.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.074 177.578 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -43.25 -38.55 2.62 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.214 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.78 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 69.5 m -83.2 -52.14 6.85 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.631 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.44 -11.58 44.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.132 0.491 . . . . 0.0 110.562 178.916 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.986 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.9 tpt -81.59 -45.25 16.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 177.306 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.929 HG21 HD12 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -74.52 -25.79 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.689 0 CA-C-N 112.58 -2.1 . . . . 0.0 112.872 -178.13 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.538 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.45 -50.37 69.99 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.842 0.829 . . . . 0.0 109.282 177.508 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.538 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 14.0 p -74.44 -31.26 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.788 -1.551 . . . . 0.0 113.572 -176.868 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.83 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -53.96 -38.41 64.95 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 122.121 0.962 . . . . 0.0 109.235 177.469 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.027 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -77.77 -41.29 38.01 Favored 'General case' 0 N--CA 1.399 -3.009 0 CA-C-N 113.878 -1.51 . . . . 0.0 110.738 -178.768 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 35' ' ' GLN . . . . . 1.027 ' N ' HD13 ' B' ' 34' ' ' LEU . 5.5 mt-30 -57.12 -62.19 1.93 Allowed 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.186 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.83 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.9 p-80 -53.33 -32.51 49.37 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.854 1.206 . . . . 0.0 110.778 179.695 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.783 ' HB2' ' NE2' ' A' ' 36' ' ' HIS . 62.8 t80 -61.94 160.01 13.08 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.306 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.59 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 10.5 mmmt . . . . . 0 C--O 1.248 0.987 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.85 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.644 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.018 0.437 . . . . 0.0 111.828 . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.406 ' C ' HD22 ' A' ' 3' ' ' LEU . 82.3 m95 -114.94 114.6 25.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.132 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.486 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -131.98 154.98 48.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.421 -178.866 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.937 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -124.38 131.55 53.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.788 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.878 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -146.02 176.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.364 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.46 ' C ' HD22 ' A' ' 7' ' ' LEU . 74.0 t-105 -97.88 97.76 9.23 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.155 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.775 HD21 ' CD1' ' A' ' 5' ' ' ILE . 1.5 mm? -121.68 112.16 18.07 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 177.08 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.445 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.4 p -80.16 -145.94 0.05 OUTLIER 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 120.786 0.327 . . . . 0.0 111.411 -178.647 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.69 ' O ' HG22 ' A' ' 11' ' ' THR . 2.5 p-10 -75.87 -159.82 0.12 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.953 -179.087 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.46 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 tt0 36.11 44.87 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.487 0.715 . . . . 0.0 112.62 179.048 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.755 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 12.4 t -176.01 -43.98 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.087 179.167 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.573 HD21 ' HB2' ' A' ' 7' ' ' LEU . 27.8 mt -71.03 -42.28 69.74 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 175.943 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -68.15 -39.5 82.63 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 113.286 -1.779 . . . . 0.0 107.521 176.017 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.755 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.1 t70 -50.21 -36.33 30.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.274 178.803 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.986 ' CD2' HD13 ' B' ' 34' ' ' LEU . 51.3 mt -66.82 6.08 0.54 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -69.16 -61.93 1.59 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.228 -0.295 . . . . 0.0 110.687 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.564 ' HA ' ' HB2' ' A' ' 21' ' ' ARG . 1.1 mttm -77.92 -11.3 59.88 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.908 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 9.6 mtm -93.95 -29.57 15.19 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.261 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.771 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -103.98 -64.49 1.1 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.917 -0.129 . . . . 0.0 111.214 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 -57.94 -63.71 1.16 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.149 0.5 . . . . 0.0 111.791 -179.61 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.564 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -51.78 -31.02 25.33 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.483 179.609 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.506 ' HB2' ' O ' ' A' ' 18' ' ' MET . 20.0 mm-40 -92.66 -6.12 49.99 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.389 179.989 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.59 -3.51 78.25 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 120.618 -0.801 . . . . 0.0 111.992 -178.58 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.771 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.7 mt -75.27 171.49 14.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.561 0.696 . . . . 0.0 111.482 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 96.0 p -118.32 163.11 17.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.59 -1.187 . . . . 0.0 109.674 178.622 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.419 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -39.43 -37.84 0.5 Allowed 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.532 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.631 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 3.4 m -83.98 -56.88 3.44 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.425 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.1 mt-10 -61.87 -9.66 7.37 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.675 0.274 . . . . 0.0 110.437 179.017 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.908 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.6 tpt -85.64 -48.34 8.97 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 122.742 1.258 . . . . 0.0 108.057 178.083 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.086 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.03 -39.87 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 112.887 -1.96 . . . . 0.0 112.873 -177.796 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.422 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -60.71 -46.25 91.11 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 122.215 1.007 . . . . 0.0 108.647 177.462 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.422 ' N ' HD22 ' A' ' 31' ' ' ASN . 1.1 t -59.36 -43.11 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 CA-C-N 113.155 -1.838 . . . . 0.0 110.509 179.844 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.775 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -55.34 -33.33 63.27 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.543 178.466 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.848 HD13 HD21 ' B' ' 15' ' ' LEU . 14.2 mt -77.68 -30.15 51.81 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.044 -178.747 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -80.1 -17.04 53.65 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.244 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -110.59 15.15 22.22 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 178.735 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.48 -166.29 0.1 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 122.942 0.497 . . . . 0.0 109.956 178.823 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HD3' ' N ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.489 1.516 . . . . 0.0 112.606 -178.091 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.375 0.131 . . . . 0.0 111.291 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 2' ' ' TRP . . . . . 0.5 ' C ' HD22 ' B' ' 3' ' ' LEU . 91.8 m95 -84.79 121.25 27.43 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.786 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.5 HD22 ' C ' ' B' ' 2' ' ' TRP . 2.3 mm? -137.36 153.19 50.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 -179.549 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.937 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -115.88 130.57 56.89 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.572 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.086 ' CD1' HG21 ' A' ' 30' ' ' ILE . 4.4 pt -142.4 172.63 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.661 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.673 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.2 t-105 -99.6 104.61 16.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -177.446 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.855 HD11 HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -132.39 114.66 14.61 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.554 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.644 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 10.4 p -77.26 -173.55 2.88 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.636 0.732 . . . . 0.0 112.702 -177.954 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -48.29 -62.93 1.23 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.336 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.69 -28.71 9.55 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.551 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.63 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 74.1 p -86.33 -32.2 21.14 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.713 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' B' ' 8' ' ' SER . 52.2 mt -71.33 -39.91 71.08 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 177.916 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -62.44 -41.67 98.9 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 113.469 -1.696 . . . . 0.0 107.793 175.989 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.7 OUTLIER -54.48 -47.54 72.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.205 178.876 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.848 HD21 HD13 ' A' ' 34' ' ' LEU . 15.2 mt -74.75 27.65 0.09 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -109.15 -55.3 2.43 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.87 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.83 -36.95 41.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.498 178.581 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.714 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 13.6 mtm -73.23 -16.82 61.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.455 178.58 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.812 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.93 -69.17 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.44 -179.485 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -69.41 0.21 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.966 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.46 -32.08 7.26 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.834 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.714 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 2.9 mt-10 -83.86 -24.36 30.9 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.386 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 0.439 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 99.18 64.04 0.84 Allowed Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.224 -0.988 . . . . 0.0 113.916 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.812 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -179.11 -177.62 0.48 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 177.77 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 25' ' ' SER . . . . . 0.588 ' N ' HD23 ' B' ' 24' ' ' LEU . 3.5 t -114.94 174.78 5.8 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.667 -179.149 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.425 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 0.0 OUTLIER -43.84 -38.92 3.56 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.083 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.545 ' HA ' HD12 ' A' ' 5' ' ' ILE . 3.2 p -80.3 -56.0 4.51 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 117.523 0.147 . . . . 0.0 111.351 -179.552 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.683 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.4 mm-40 -62.93 -11.8 21.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.555 0.217 . . . . 0.0 110.534 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.805 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.1 tpt -81.97 -47.6 12.5 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 122.699 1.238 . . . . 0.0 107.736 177.911 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.878 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -74.31 -37.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.11 0 CA-C-N 112.894 -1.957 . . . . 0.0 112.944 -177.846 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -61.57 -48.38 81.23 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 122.26 1.029 . . . . 0.0 108.543 176.9 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.503 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -58.04 -41.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 CA-C-N 113.015 -1.902 . . . . 0.0 111.561 -179.436 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.764 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -53.16 -37.61 62.03 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.902 179.194 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.986 HD13 ' CD2' ' A' ' 15' ' ' LEU . 15.4 mt -75.56 -31.97 60.23 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.774 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -77.82 -17.79 57.05 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.516 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -96.23 -35.28 11.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 121.259 -0.176 . . . . 0.0 110.99 177.796 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.545 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 13.4 t80 -40.89 143.09 0.4 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.651 0.38 . . . . 0.0 111.091 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt . . . . . 0 C--O 1.251 1.139 0 C-N-CA 123.587 0.755 . . . . 0.0 112.299 179.035 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.706 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.5 mpt_? . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.917 0.389 . . . . 0.0 111.518 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.415 ' C ' HD22 ' A' ' 3' ' ' LEU . 87.9 m95 -104.68 116.35 31.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.001 178.745 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -133.21 157.4 45.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.72 -179.57 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -113.88 138.41 50.34 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.783 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.572 ' CD1' ' HB2' ' A' ' 7' ' ' LEU . 2.3 pp -154.69 167.5 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.37 0.605 . . . . 0.0 112.351 -178.589 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.521 ' O ' ' HB3' ' B' ' 27' ' ' SER . 68.0 t-105 -79.02 88.69 4.78 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.374 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.615 HD23 HD22 ' B' ' 3' ' ' LEU . 29.9 tp -125.83 84.62 2.29 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.938 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.608 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 47.9 p -63.41 175.39 1.02 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 122.248 1.023 . . . . 0.0 113.631 -177.067 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.99 -44.46 78.61 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 113.186 -1.825 . . . . 0.0 112.709 -179.35 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -40.54 -37.59 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.748 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.762 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.4 t -109.29 -11.03 14.92 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -178.859 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 8' ' ' SER . 66.5 mt -70.05 -38.44 75.82 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 175.881 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.89 -40.79 98.61 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.164 -1.835 . . . . 0.0 107.952 176.018 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.762 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -53.14 -42.99 66.6 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.461 178.497 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.033 HD21 HD13 ' B' ' 34' ' ' LEU . 28.9 mt -75.86 19.71 0.2 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -99.27 -50.24 4.19 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.28 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -81.37 -33.63 32.24 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.712 178.528 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.553 ' O ' ' HB3' ' A' ' 22' ' ' GLU . 25.0 mtm -67.65 -69.92 0.29 Allowed 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.092 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.748 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -37.27 -44.91 0.62 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.558 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -70.23 0.27 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.064 0.459 . . . . 0.0 111.309 -179.764 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -52.01 -27.43 13.52 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.573 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.609 ' OE1' HG11 ' A' ' 32' ' ' VAL . 0.0 OUTLIER -86.11 -35.23 20.34 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.81 -179.874 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.55 ' O ' ' HB3' ' A' ' 24' ' ' LEU . . . 102.12 73.3 0.99 Allowed Glycine 0 C--N 1.342 0.863 0 C-N-CA 120.5 -0.857 . . . . 0.0 113.753 178.87 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.748 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER 169.46 -174.35 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 121.354 0.597 . . . . 0.0 112.346 177.962 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.06 169.42 8.45 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.67 -40.2 4.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -179.069 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.808 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 23.9 m -78.08 -56.47 4.45 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.598 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mt-10 -60.54 -18.71 54.02 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.055 0.455 . . . . 0.0 109.838 178.762 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.935 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.2 tpt -71.53 -47.86 52.5 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 123.122 1.439 . . . . 0.0 107.916 177.952 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.059 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -69.61 -28.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.614 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.155 -178.484 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.427 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -67.08 -49.39 65.19 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.937 0.875 . . . . 0.0 108.946 177.052 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.609 HG11 ' OE1' ' A' ' 22' ' ' GLU . 0.9 OUTLIER -57.4 -42.42 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.95 -179.905 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.873 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.87 -39.84 54.95 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.038 178.976 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.099 HD13 HD21 ' B' ' 15' ' ' LEU . 13.5 mt -73.45 -28.98 62.25 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.474 -178.32 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.93 -19.76 50.99 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.08 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -104.61 -35.89 7.67 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 178.281 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.576 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.3 t80 -30.79 130.87 0.1 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.0 0.52 . . . . 0.0 112.135 -179.753 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.437 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 117.993 -1.003 . . . . 0.0 112.07 177.956 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.608 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.802 0.334 . . . . 0.0 111.523 . . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -74.78 145.64 42.77 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.322 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.615 HD22 HD23 ' A' ' 7' ' ' LEU . 1.7 tp -158.05 150.63 22.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.165 -178.85 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.3 m -111.02 140.68 45.35 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.059 HD12 HG21 ' A' ' 30' ' ' ILE . 3.7 pt -148.41 179.8 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.98 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.808 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.3 t-105 -99.96 101.41 12.5 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -177.187 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.829 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -133.47 113.1 12.12 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 177.172 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.706 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -89.84 -165.83 1.44 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.415 0.626 . . . . 0.0 112.302 -178.132 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -47.79 -65.4 0.57 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.774 -178.476 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -49.3 -25.38 2.35 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.532 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.699 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 30.2 p -94.65 -38.89 10.62 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.552 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' B' ' 8' ' ' SER . 74.6 mt -63.93 -40.83 97.36 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 178.412 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.33 -43.18 98.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 113.747 -1.57 . . . . 0.0 107.975 176.298 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.699 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.71 -45.28 70.39 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.332 178.751 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.099 HD21 HD13 ' A' ' 34' ' ' LEU . 18.0 mt -72.72 28.36 0.06 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.343 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.524 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 6.2 mm-40 -109.55 -56.28 2.32 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.16 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.489 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 1.1 mttm -75.86 -25.53 56.27 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 178.698 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.855 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.0 mtm -87.04 -23.35 25.0 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.208 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.717 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.34 -67.63 0.85 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -54.07 -67.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 21' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 4.8 mmm180 -49.01 -32.31 9.05 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.383 179.717 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.4 mm-40 -88.94 -6.64 57.13 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.466 179.808 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.42 -8.07 69.78 Favored Glycine 0 C--N 1.338 0.687 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.814 -178.526 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.717 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.6 mt -74.12 170.91 14.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.668 0.747 . . . . 0.0 111.605 -179.901 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.6 m -118.62 162.7 17.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.37 178.281 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.458 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -40.55 -37.46 0.71 Allowed 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -179.077 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.521 ' HB3' ' O ' ' A' ' 6' ' ' TRP . 0.7 OUTLIER -82.55 -57.56 3.29 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 122.697 0.399 . . . . 0.0 111.689 -179.538 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.53 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.2 mt-10 -61.69 -10.87 9.59 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.34 178.899 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 29' ' ' MET . . . . . 1.031 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.5 tpt -83.71 -47.86 10.74 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.769 1.271 . . . . 0.0 107.836 177.955 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.767 HD13 HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -73.64 -33.25 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.09 0 CA-C-N 112.791 -2.004 . . . . 0.0 113.147 -177.906 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.13 -48.7 56.4 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.94 0.876 . . . . 0.0 109.338 177.394 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.2 t -56.22 -40.3 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-N 113.499 -1.682 . . . . 0.0 110.642 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.722 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -53.63 -32.68 52.33 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.482 179.005 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.033 HD13 HD21 ' A' ' 15' ' ' LEU . 11.3 mt -82.36 -32.83 29.09 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.78 -177.825 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -80.54 -8.42 59.57 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.607 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -112.17 8.21 19.81 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.488 0.185 . . . . 0.0 111.327 177.665 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.544 ' CD2' ' HD2' ' B' ' 38' ' ' LYS . 3.3 t80 -66.3 -169.29 0.07 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.085 0.554 . . . . 0.0 109.6 178.592 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.544 ' HD2' ' CD2' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.363 1.465 . . . . 0.0 112.915 -178.408 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 120.815 0.34 . . . . 0.0 111.864 . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -98.37 114.6 26.99 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.444 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.548 HD21 HG12 ' A' ' 5' ' ' ILE . 3.2 tp -122.25 142.39 50.51 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.266 -177.931 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.6 OUTLIER -123.76 128.77 50.05 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.663 178.217 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 1.028 HD12 HD21 ' A' ' 7' ' ' LEU . 1.1 pp -155.75 173.71 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -178.076 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.674 ' O ' HD13 ' A' ' 7' ' ' LEU . 74.9 t-105 -95.28 112.64 24.32 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -176.83 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.028 HD21 HD12 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -129.52 122.65 29.65 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.519 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.893 ' C ' HD23 ' A' ' 12' ' ' LEU . 9.8 p -80.31 -173.23 3.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.318 0.58 . . . . 0.0 110.412 -179.802 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -61.93 -162.11 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.201 -178.645 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.495 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.54 40.43 0.12 Allowed 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.635 0.774 . . . . 0.0 112.805 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.718 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 2.0 t -179.78 -56.46 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.002 179.441 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.931 HD22 ' HB2' ' B' ' 1' ' ' ARG . 0.6 OUTLIER -62.61 -29.1 70.36 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 175.831 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.458 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 2.8 mm-40 -92.43 -37.5 12.52 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.609 -1.632 . . . . 0.0 108.692 177.201 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.718 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -45.34 -31.03 1.45 Allowed 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.718 179.472 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.99 HD22 ' CG ' ' A' ' 29' ' ' MET . 43.8 mt -72.47 19.21 0.08 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 179.609 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -95.88 -48.6 5.66 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.217 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -84.63 -38.09 20.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.556 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.461 ' O ' ' N ' ' A' ' 20' ' ' ARG . 17.2 mtm -64.26 -72.69 0.14 Allowed 'General case' 0 C--N 1.341 0.239 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.427 179.466 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.812 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -28.5 -32.17 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.888 1.368 . . . . 0.0 113.934 -178.602 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.505 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 3.7 mmm180 -66.22 -121.2 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 119.729 -0.789 . . . . 0.0 110.35 179.194 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.38 -23.13 8.81 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 121.876 -0.515 . . . . 0.0 111.671 179.51 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.457 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 1.3 mp0 -109.07 -2.85 17.84 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -177.198 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.812 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -150.19 21.31 1.09 Allowed Glycine 0 C--O 1.221 -0.713 0 C-N-CA 115.766 -3.111 . . . . 0.0 117.693 -176.756 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.673 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.2 mp 51.31 -159.88 0.09 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 119.74 1.77 . . . . 0.0 113.353 175.63 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -60.82 165.21 4.15 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 114.282 -1.326 . . . . 0.0 110.373 178.535 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -43.87 66.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.311 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 m -80.71 -46.92 14.75 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.283 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.576 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 2.5 mm-40 -57.36 -27.49 62.33 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.591 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.99 ' CG ' HD22 ' A' ' 15' ' ' LEU . 4.2 tpt -63.61 -48.3 77.88 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 122.925 1.345 . . . . 0.0 109.109 177.702 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.966 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -77.94 -29.78 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.582 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.128 -176.282 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.75 -50.02 33.83 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.052 0.929 . . . . 0.0 109.459 177.785 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.3 t -57.85 -42.86 83.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.817 -179.488 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.936 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -50.51 -27.71 7.12 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.625 179.154 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.928 HD13 HD21 ' B' ' 15' ' ' LEU . 10.9 mt -91.42 -30.91 16.24 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.922 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -75.7 -14.24 60.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.076 0.398 . . . . 0.0 112.076 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -111.04 35.6 3.48 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.491 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.586 ' CD2' ' N ' ' A' ' 38' ' ' LYS . 67.3 t80 -74.31 162.22 29.11 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.341 -178.735 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.586 ' N ' ' CD2' ' A' ' 37' ' ' TYR . 6.8 mmmt . . . . . 0 C--O 1.251 1.136 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.086 177.794 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.931 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 120.785 0.326 . . . . 0.0 111.878 . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 2' ' ' TRP . . . . . 0.437 ' C ' HD22 ' B' ' 3' ' ' LEU . 97.6 m95 -89.56 122.46 32.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.834 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 mm? -133.61 151.07 51.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.958 0.409 . . . . 0.0 111.95 -178.605 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -123.78 124.25 42.28 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.257 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.966 ' CD1' HG21 ' A' ' 30' ' ' ILE . 3.8 pt -147.21 176.99 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.794 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.677 ' O ' HD13 ' B' ' 7' ' ' LEU . 70.6 t-105 -96.9 101.82 13.48 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.268 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.904 HD11 HG22 ' A' ' 30' ' ' ILE . 0.7 OUTLIER -130.85 112.26 12.85 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.476 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.582 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 9.8 p -84.76 178.92 7.46 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.029 0.919 . . . . 0.0 113.028 -177.89 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -47.69 -49.15 28.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 113.321 -1.763 . . . . 0.0 112.781 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -43.46 -35.02 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.527 -178.846 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.771 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 3.9 t -112.28 -7.74 13.99 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -179.202 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' B' ' 8' ' ' SER . 73.8 mt -72.88 -38.96 66.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 175.762 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.54 -41.35 98.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.285 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.771 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -52.2 -43.05 64.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.622 178.794 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.928 HD21 HD13 ' A' ' 34' ' ' LEU . 16.5 mt -79.09 22.88 0.38 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.628 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -43.35 4.48 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -80.71 -46.91 14.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.301 0.24 . . . . 0.0 111.524 179.824 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.781 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -81.32 10.04 6.2 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.413 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -111.04 -61.06 1.75 Allowed 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.542 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.492 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 29.9 mmm-85 -62.0 -63.51 1.23 Allowed 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.182 0.515 . . . . 0.0 111.505 179.191 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -34.56 35.35 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.844 179.534 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -80.48 -12.65 59.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.673 179.27 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.59 -12.91 68.69 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.76 -178.666 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.426 HD22 ' HB3' ' B' ' 28' ' ' GLU . 43.4 mt -74.26 175.3 7.72 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.907 0.86 . . . . 0.0 112.22 -179.793 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -118.33 173.29 6.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.166 178.139 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.56 -38.85 60.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 7.3 m -79.79 -52.66 7.64 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.539 0.209 . . . . 0.0 111.029 179.819 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.426 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.7 mm-40 -63.82 -13.52 45.25 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.262 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.786 ' HG2' ' HB3' ' B' ' 15' ' ' LEU . 1.2 tpt -80.84 -45.77 16.37 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 123.714 1.721 . . . . 0.0 107.176 177.129 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 1.022 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.71 -17.91 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.772 0 CA-C-N 112.943 -1.935 . . . . 0.0 111.957 -179.099 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.411 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -80.34 -47.51 14.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.075 176.82 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.754 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.1 OUTLIER -59.25 -30.94 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 CA-C-O 121.665 0.745 . . . . 0.0 108.996 178.549 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 1.034 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -37.42 -44.35 0.63 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 113.722 -1.581 . . . . 0.0 110.924 177.919 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.9 HD22 HD21 ' A' ' 15' ' ' LEU . 9.2 mt -83.78 -30.45 26.59 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.534 -179.392 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 35' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' B' ' 32' ' ' VAL . 66.7 mt-30 -82.89 -15.61 50.8 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.426 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 1.034 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 1.0 OUTLIER -118.3 6.06 11.89 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.974 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.679 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 1.0 OUTLIER -78.49 137.84 38.14 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.172 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.451 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 117.931 -1.033 . . . . 0.0 112.025 178.366 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.881 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 . . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -88.96 118.39 28.65 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.107 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 mm? -131.85 154.76 48.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.73 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -127.03 135.23 50.53 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 178.775 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 1.028 HD13 HD13 ' A' ' 7' ' ' LEU . 2.3 pp -151.12 171.86 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.898 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.62 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 73.2 t-105 -84.76 91.64 8.02 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.036 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.028 HD13 HD13 ' A' ' 5' ' ' ILE . 2.9 mp -131.45 98.68 4.59 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 177.038 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.83 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -74.07 -168.22 0.6 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.525 0.678 . . . . 0.0 112.127 -177.863 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -55.17 -54.39 43.88 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.478 -1.237 . . . . 0.0 113.078 -178.214 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -50.35 -22.58 1.89 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.47 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 15.7 p -96.72 -25.46 15.52 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.718 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 8' ' ' SER . 20.0 mt -78.8 -37.33 41.11 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 178.613 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.96 -41.29 78.04 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 174.985 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.577 ' O ' ' HG3' ' A' ' 18' ' ' MET . 0.1 OUTLIER -55.63 -47.44 76.59 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.683 177.421 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.867 HD21 HD22 ' B' ' 34' ' ' LEU . 22.3 mt -81.32 31.56 0.34 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.829 179.657 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.425 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -113.78 -49.58 2.87 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.687 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.425 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 2.1 ptmm? -88.83 -28.8 20.16 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.613 0.365 . . . . 0.0 111.056 178.577 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.66 ' HE2' HD23 ' A' ' 15' ' ' LEU . 6.9 mtm -87.04 -8.17 57.38 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.567 178.743 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.888 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -89.69 -18.99 25.37 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.063 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' A' ' 16' ' ' GLU . 0.1 OUTLIER -64.28 -134.77 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.863 -179.485 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.36 -22.5 1.14 Allowed 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.552 -0.717 . . . . 0.0 110.199 178.274 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.524 ' HB3' ' OH ' ' B' ' 37' ' ' TYR . 1.8 mp0 -90.9 -22.14 21.06 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -178.526 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.888 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -139.2 17.97 3.13 Favored Glycine 0 CA--C 1.504 -0.646 0 C-N-CA 117.313 -2.375 . . . . 0.0 116.702 -176.736 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.74 HD12 ' C ' ' A' ' 23' ' ' GLY . 0.9 OUTLIER 53.75 -163.26 0.11 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 118.679 1.24 . . . . 0.0 114.212 174.953 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.66 163.33 3.32 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 113.727 -1.579 . . . . 0.0 110.593 178.692 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -51.13 -43.81 61.24 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.801 0.296 . . . . 0.0 111.801 -179.474 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -77.08 -39.59 49.19 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.543 0.211 . . . . 0.0 111.023 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.623 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.8 mt-10 -64.81 -36.45 84.37 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.282 179.508 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.862 ' HE3' HG23 ' A' ' 32' ' ' VAL . 2.4 tpt -61.3 -44.66 96.84 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 123.96 1.838 . . . . 0.0 108.407 177.445 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.983 HG21 HD13 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -68.28 -18.6 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 112.97 -1.923 . . . . 0.0 112.265 -177.543 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.14 -45.23 16.72 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.168 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.862 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -60.39 -32.33 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.467 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 1.053 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.98 -42.0 1.3 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.163 -1.38 . . . . 0.0 110.536 177.83 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.927 HD22 HD21 ' B' ' 15' ' ' LEU . 9.8 mt -83.12 -29.7 28.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.726 -179.674 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.444 ' N ' ' O ' ' A' ' 32' ' ' VAL . 8.5 mt-30 -87.67 -18.62 29.15 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.489 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 1.053 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -109.44 4.52 22.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.418 0.554 . . . . 0.0 112.412 179.687 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.585 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.9 t80 -79.85 145.61 32.65 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.661 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.477 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.729 -0.653 . . . . 0.0 112.245 179.48 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.83 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.908 0.385 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 2' ' ' TRP . . . . . 0.484 ' O ' ' HD3' ' B' ' 1' ' ' ARG . 99.2 m95 -69.26 174.84 4.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.697 179.896 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.536 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 tp -169.14 137.38 1.95 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -117.16 138.69 51.5 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.683 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.043 HD12 HD21 ' B' ' 7' ' ' LEU . 1.3 pp -161.81 173.63 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.222 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.518 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.7 t-105 -93.0 114.25 26.75 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.463 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 1.043 HD21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -128.97 123.78 33.34 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.561 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.868 ' O ' HD23 ' B' ' 12' ' ' LEU . 11.6 p -81.5 -174.24 4.85 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.839 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -63.3 -163.55 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.808 -178.827 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 10' ' ' GLN . . . . . 0.408 ' O ' ' HB ' ' B' ' 11' ' ' THR . 0.0 OUTLIER 35.37 41.75 0.09 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.447 0.699 . . . . 0.0 112.723 179.014 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.642 ' HA ' ' CB ' ' B' ' 14' ' ' ASP . 0.7 OUTLIER -178.38 -56.15 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.998 179.678 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.881 HD22 ' HB2' ' A' ' 1' ' ' ARG . 1.0 OUTLIER -61.97 -30.38 70.89 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.445 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -95.46 -35.87 11.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.06 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.642 ' CB ' ' HA ' ' B' ' 11' ' ' THR . 6.6 t70 -44.69 -31.17 1.09 Allowed 'General case' 0 C--N 1.343 0.306 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.217 179.779 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.927 HD21 HD22 ' A' ' 34' ' ' LEU . 44.2 mt -67.64 14.69 0.05 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.496 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -83.23 -42.11 17.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.262 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.487 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 5.1 mtpm? -91.37 -21.62 20.9 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.368 179.009 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.872 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 2.6 mtm -83.98 -26.51 29.14 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.586 -179.731 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.744 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.22 -69.51 0.76 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.637 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -53.16 -67.82 0.22 Allowed 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.35 -33.71 14.13 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.365 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.562 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.3 mm-40 -85.5 -11.2 54.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.16 179.703 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.94 -9.1 78.42 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.624 -178.219 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.744 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 60.3 mt -75.76 177.77 6.63 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 121.543 0.687 . . . . 0.0 111.52 179.963 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.1 p -124.51 170.41 10.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.98 -40.59 6.56 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.62 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 3.8 p -85.83 -51.37 6.45 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -179.802 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.579 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.9 mm-40 -64.04 -4.18 3.24 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 121.388 -0.125 . . . . 0.0 111.292 179.579 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.872 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 3.5 tpt -94.33 -50.3 5.31 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 177.666 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.874 HG22 HD11 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -73.59 -36.66 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.911 0 CA-C-N 113.311 -1.768 . . . . 0.0 112.677 -178.426 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.428 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.62 -48.94 65.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.941 0.877 . . . . 0.0 109.441 177.344 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.579 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -59.92 -36.79 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.376 -179.851 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.944 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -50.74 -32.47 19.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.105 179.209 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.867 HD22 HD21 ' A' ' 15' ' ' LEU . 13.4 mt -90.64 -28.92 18.07 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.557 -177.634 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -68.92 -19.66 64.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.49 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -102.84 25.71 8.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.863 0.363 . . . . 0.0 110.382 177.101 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.68 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 1.4 t80 -103.8 144.49 31.42 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.667 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.68 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 2.1 mppt? . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.191 178.159 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.75 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.8 mpt_? . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 120.921 0.391 . . . . 0.0 111.661 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -100.19 121.19 41.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.48 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.507 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -132.44 137.07 47.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.49 -178.63 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.935 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -119.34 128.39 54.07 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.553 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.92 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -151.29 -178.86 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.231 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.423 ' O ' HD13 ' A' ' 7' ' ' LEU . 76.2 t-105 -93.52 96.39 9.84 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -177.097 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.817 HD11 HG22 ' B' ' 30' ' ' ILE . 1.4 mm? -121.54 117.73 27.5 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 176.39 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.696 ' C ' HD23 ' A' ' 12' ' ' LEU . 50.7 p -65.84 165.93 12.04 Favored 'General case' 0 N--CA 1.427 -1.589 0 CA-C-O 122.21 1.005 . . . . 0.0 111.283 -178.336 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.466 ' CG ' ' HG3' ' A' ' 13' ' ' GLU . 5.8 t70 -60.65 -35.74 76.96 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 113.237 -1.801 . . . . 0.0 113.077 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -71.37 32.25 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.629 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.755 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -171.18 -50.26 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 122.881 0.472 . . . . 0.0 111.787 178.618 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.789 ' CD2' ' HD2' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -56.3 -29.83 61.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.836 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.466 ' HG3' ' CG ' ' A' ' 9' ' ' ASP . 3.0 mm-40 -88.28 -38.24 15.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.321 -1.309 . . . . 0.0 108.571 177.393 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.755 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 4.7 t70 -44.72 -24.45 0.2 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.214 178.158 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.94 HD21 HD13 ' B' ' 34' ' ' LEU . 50.1 mt -67.51 14.6 0.05 Allowed 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.325 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.8 mt-10 -87.01 -44.62 11.45 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.42 ' HG2' ' NH2' ' A' ' 21' ' ' ARG . 18.2 mttp -79.5 -22.77 43.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.067 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.986 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 5.0 mtm -90.25 -23.61 21.18 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.047 -179.167 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.748 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -102.3 -65.87 0.96 Allowed 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.4 mtp85 -55.41 -67.7 0.26 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.013 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' NH2' ' HG2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -50.27 -30.84 12.71 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.227 179.917 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 18' ' ' MET . 7.2 mm-40 -88.66 -7.39 56.43 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.499 179.958 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.98 -9.55 68.8 Favored Glycine 0 C--N 1.34 0.793 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.127 -179.114 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.748 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 68.2 mt -73.07 178.47 4.35 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.508 0.671 . . . . 0.0 111.301 179.92 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -124.91 172.31 9.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.916 178.755 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.475 ' HB3' ' CG2' ' B' ' 5' ' ' ILE . 0.6 OUTLIER -46.15 -39.8 10.14 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.139 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.689 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 1.3 p -87.87 -50.18 6.61 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.445 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.4 mt-10 -63.58 -6.32 5.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.624 0.249 . . . . 0.0 110.484 178.96 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.986 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.4 tpt -89.73 -50.01 6.31 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-O 122.562 1.173 . . . . 0.0 107.983 178.075 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.084 HG22 HD11 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -73.77 -38.57 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.064 0 CA-C-N 113.202 -1.817 . . . . 0.0 112.444 -178.004 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -61.88 -46.76 88.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 122.091 0.948 . . . . 0.0 108.56 176.684 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.445 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.85 -41.22 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.219 -179.979 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.69 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -53.36 -34.79 58.98 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.656 178.915 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.862 HD13 HD21 ' B' ' 15' ' ' LEU . 10.3 mt -79.38 -29.07 41.91 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.256 -178.874 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -79.16 -16.98 55.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.785 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.9 m80 -102.95 2.61 35.34 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.594 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.663 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 1.9 t80 -67.4 -168.95 0.09 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.543 0.337 . . . . 0.0 111.078 179.718 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.455 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 C-N-CA 125.866 1.666 . . . . 0.0 112.818 -178.535 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.789 ' HD2' ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.819 0.343 . . . . 0.0 111.145 . . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.84 130.57 41.37 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.057 0.456 . . . . 0.0 110.941 -179.266 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -130.57 142.93 50.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.542 -178.859 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.935 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -127.87 132.84 49.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.739 179.108 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.063 HD12 HG21 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -150.27 -175.28 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.465 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.798 ' O ' HD13 ' B' ' 7' ' ' LEU . 76.6 t-105 -103.79 92.32 4.37 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -177.252 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 1.084 HD11 HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -128.45 112.9 14.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.412 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.75 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.2 OUTLIER -86.35 -164.99 1.13 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.764 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -45.27 -66.46 0.4 Allowed 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.067 -1.424 . . . . 0.0 113.691 -178.044 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -47.88 -22.07 0.51 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.275 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.644 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 28.9 p -101.26 -35.5 9.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.433 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' B' ' 8' ' ' SER . 55.1 mt -69.7 -41.06 75.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 178.475 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -60.91 -41.86 96.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.84 -1.527 . . . . 0.0 107.442 175.858 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.644 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.3 OUTLIER -51.83 -39.28 58.55 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.172 178.367 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.862 HD21 HD13 ' A' ' 34' ' ' LEU . 27.0 mt -78.38 29.91 0.18 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.412 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -104.47 -59.51 1.73 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.435 ' HG3' ' N ' ' B' ' 18' ' ' MET . 6.7 pttm -71.32 -21.73 62.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.72 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.871 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 7.5 mtm -91.17 -18.45 24.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.193 -179.866 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.734 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -103.19 -67.15 0.9 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.909 179.101 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -59.98 -66.29 0.54 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 120.914 0.388 . . . . 0.0 112.034 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.7 -33.25 15.39 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 18' ' ' MET . 6.8 mm-40 -85.87 -10.83 54.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.351 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.58 -10.75 73.64 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.9 -178.681 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.734 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 57.4 mt -71.99 177.26 4.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.606 0.717 . . . . 0.0 111.561 179.779 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 37.5 p -123.44 168.04 13.06 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.46 178.784 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.19 -40.82 5.34 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.357 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.861 ' HA ' HD12 ' A' ' 5' ' ' ILE . 2.2 p -83.68 -51.49 7.22 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.402 ' O ' HG12 ' B' ' 32' ' ' VAL . 2.9 mm-40 -63.64 -7.21 6.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.654 0.264 . . . . 0.0 110.816 178.878 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.871 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.7 tpt -89.18 -49.47 6.72 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 177.781 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.92 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -72.35 -27.95 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.288 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.696 -178.335 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.444 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.83 -52.36 37.75 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.627 0.727 . . . . 0.0 109.785 177.204 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.444 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 10.0 p -63.88 -32.65 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.819 -177.392 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.885 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -49.36 -32.05 10.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.892 177.437 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.94 HD13 HD21 ' A' ' 15' ' ' LEU . 14.4 mt -88.72 -26.64 21.68 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.159 -177.121 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -75.84 -27.51 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -177.614 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.885 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 6.4 p-80 -89.43 -33.47 16.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.963 0.801 . . . . 0.0 111.022 177.627 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.433 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 20.4 t80 -35.89 144.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.998 0.519 . . . . 0.0 111.877 -179.533 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt . . . . . 0 C--O 1.25 1.101 0 C-N-CA 123.611 0.765 . . . . 0.0 112.178 178.938 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.584 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 111.652 0.242 . . . . 0.0 111.652 . . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -71.54 123.57 22.75 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.713 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.504 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.2 tp -122.1 132.66 54.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.655 -178.589 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.969 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -117.7 117.92 30.66 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.126 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.888 HD11 HG21 ' B' ' 30' ' ' ILE . 5.5 pt -143.26 176.42 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.827 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.507 ' O ' HD13 ' A' ' 7' ' ' LEU . 74.4 t-105 -98.74 105.25 17.37 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -177.025 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.737 HD11 HG22 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -128.7 123.63 33.57 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.781 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.974 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -86.29 -163.48 0.89 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.171 -179.555 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.708 ' O ' HG22 ' A' ' 11' ' ' THR . 3.1 t70 -63.61 -165.14 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.381 -177.949 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.541 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.7 tt0 36.83 40.68 0.15 Allowed 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.543 0.737 . . . . 0.0 112.761 179.307 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.708 HG22 ' O ' ' A' ' 9' ' ' ASP . 11.2 t 177.39 -51.21 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.274 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.974 HD23 ' C ' ' A' ' 8' ' ' SER . 0.5 OUTLIER -68.44 -30.19 69.01 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.516 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.78 -40.16 12.66 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 113.745 -1.57 . . . . 0.0 107.706 177.577 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.685 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -44.17 -28.88 0.55 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.803 179.266 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.919 HD21 HD13 ' B' ' 34' ' ' LEU . 34.9 mt -69.2 20.21 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.467 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -97.18 -44.32 6.99 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.674 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 21.7 mtpp -87.73 -26.86 22.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.797 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 7.6 mtm -82.39 -14.5 55.11 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.959 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.774 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -100.63 -64.66 1.02 Allowed 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.525 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 -61.53 -69.86 0.22 Allowed 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -178.838 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 13.2 mmp_? -50.38 -29.8 10.84 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.929 -179.966 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.651 ' HG3' ' HA ' ' A' ' 18' ' ' MET . 4.3 mm-40 -84.57 -26.6 27.86 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -179.639 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.75 67.34 0.95 Allowed Glycine 0 C--N 1.337 0.615 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.771 178.585 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.774 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -176.94 179.5 1.04 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.099 0.475 . . . . 0.0 111.587 177.562 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.452 ' N ' HD23 ' A' ' 24' ' ' LEU . 84.5 p -100.19 165.54 11.44 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.414 -178.791 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 1.1 mmmm -48.23 -35.72 12.46 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.471 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.5 m -78.55 -58.33 3.3 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 122.239 0.216 . . . . 0.0 110.781 179.88 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.478 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.0 mm-40 -57.77 -16.84 12.52 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 178.431 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.797 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 0.8 OUTLIER -75.42 -50.33 16.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 122.621 1.2 . . . . 0.0 108.115 177.86 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.79 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -70.63 -34.17 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.122 0 CA-C-N 113.007 -1.906 . . . . 0.0 113.069 -177.697 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.451 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -66.79 -49.03 67.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.046 0.927 . . . . 0.0 108.794 177.023 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.478 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -54.93 -42.1 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.626 -179.702 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.774 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -46.75 -36.15 6.93 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.188 179.367 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 1.097 HD13 ' CD1' ' B' ' 15' ' ' LEU . 10.5 mt -77.56 -37.1 51.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.009 -178.081 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -71.22 -17.05 62.52 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.484 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -107.02 27.23 9.21 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 177.142 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.745 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 9.8 t80 -117.08 146.7 42.95 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.667 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.636 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.1 0 C-N-CA 123.74 0.816 . . . . 0.0 112.117 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.922 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.159 0.504 . . . . 0.0 111.944 . . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -101.87 117.48 34.94 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.953 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.545 HD21 HD11 ' B' ' 5' ' ' ILE . 15.8 tp -108.12 132.88 53.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.531 -177.966 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.969 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -126.91 119.36 26.55 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.212 178.442 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.7 HD12 HD21 ' B' ' 7' ' ' LEU . 1.0 OUTLIER -152.65 -178.23 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.363 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.573 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.1 t-105 -93.49 91.48 7.15 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -177.726 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.79 HD11 HG22 ' A' ' 30' ' ' ILE . 2.1 mm? -128.75 104.14 7.46 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.429 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.584 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 8.8 t -69.66 -135.71 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.891 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -90.23 -38.76 13.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -177.631 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 10' ' ' GLN . . . . . 0.577 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 1.4 mt-30 -73.59 41.83 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.087 0.47 . . . . 0.0 111.717 -179.181 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.736 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 1.1 t -165.27 -37.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 178.826 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.416 ' CD2' HD22 ' A' ' 3' ' ' LEU . 15.4 mt -79.87 -42.87 23.33 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.112 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.35 -30.25 22.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.619 177.576 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.736 ' HB2' ' N ' ' B' ' 11' ' ' THR . 5.6 t70 -41.99 -19.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.002 -1.454 . . . . 0.0 113.333 -179.052 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.097 ' CD1' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -137.14 56.02 1.8 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 179.272 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.579 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 4.1 mt-10 -56.57 -25.27 51.84 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.929 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.695 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 9.1 mttp -84.68 -45.07 12.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.948 179.399 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 18' ' ' MET . . . . . 1.051 ' HE3' ' HG ' ' B' ' 15' ' ' LEU . 20.3 mtm -59.09 -25.89 64.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.796 0.331 . . . . 0.0 110.591 179.614 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.7 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -100.91 -64.82 1.01 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.352 179.581 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.579 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 2.9 mtp85 -67.06 -65.14 0.72 Allowed 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.112 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 21' ' ' ARG . . . . . 0.695 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.96 -34.33 20.51 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.512 -179.859 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.504 ' HB2' ' O ' ' B' ' 18' ' ' MET . 8.8 mm-40 -82.43 -14.53 54.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.017 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.9 -5.98 83.06 Favored Glycine 0 C--N 1.339 0.707 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.702 -178.546 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.778 HD12 ' O ' ' B' ' 18' ' ' MET . 76.6 mt -71.8 177.57 4.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 111.681 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 25' ' ' SER . . . . . 0.485 ' O ' ' HB3' ' B' ' 29' ' ' MET . 25.1 p -119.0 169.33 9.99 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.261 178.418 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.41 -37.66 17.61 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.492 ' HA ' HD12 ' A' ' 5' ' ' ILE . 6.0 p -87.02 -49.76 7.11 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.566 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.459 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.4 mm-40 -61.12 -11.62 9.45 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 121.046 -0.262 . . . . 0.0 111.019 179.686 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.902 ' HG2' HD21 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -85.28 -43.05 14.08 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 176.748 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.888 HG21 HD11 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -78.99 -24.59 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-N 113.616 -1.629 . . . . 0.0 113.789 -176.942 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.523 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -66.26 -53.92 31.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.658 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.523 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 15.0 p -64.29 -32.6 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.673 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.333 -177.69 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.906 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -52.3 -27.97 17.26 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.651 177.195 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.919 HD13 HD21 ' A' ' 15' ' ' LEU . 13.4 mt -90.31 -27.15 19.61 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.416 -178.374 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -69.18 -37.25 78.06 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -178.049 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.906 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 4.5 p-80 -81.77 -41.45 21.16 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 118.952 0.796 . . . . 0.0 110.772 178.309 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 28.3 t80 -48.48 150.24 1.4 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.907 -179.42 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 117.947 -1.025 . . . . 0.0 112.3 178.172 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.713 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.096 0.474 . . . . 0.0 111.914 . . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -110.36 117.21 33.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 177.353 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -127.8 140.93 51.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.725 -177.883 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.923 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -120.73 129.87 53.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.414 178.624 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.612 ' CD1' HG21 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -150.85 -176.94 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.5 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.614 ' C ' HD22 ' A' ' 7' ' ' LEU . 70.9 t-105 -92.69 94.79 9.19 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.591 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.91 HD11 HG22 ' B' ' 30' ' ' ILE . 1.8 mm? -130.36 105.44 7.89 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.3 177.76 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 51.8 p -67.7 -139.18 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.582 0.229 . . . . 0.0 110.941 -178.855 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -99.0 -142.64 0.32 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 119.558 -0.258 . . . . 0.0 111.386 -179.191 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.412 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.0 OUTLIER 33.38 42.11 0.04 OUTLIER 'General case' 0 C--N 1.346 0.445 0 C-N-CA 123.455 0.702 . . . . 0.0 112.67 179.401 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.678 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -176.34 -49.9 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.989 179.488 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.847 HD22 HD22 ' B' ' 3' ' ' LEU . 47.7 mt -71.22 -39.8 71.49 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 176.016 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -40.44 65.0 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 113.134 -1.848 . . . . 0.0 107.04 176.088 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.678 ' CB ' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -49.39 -27.46 4.09 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 113.497 -1.683 . . . . 0.0 110.753 179.108 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.025 HD21 HD13 ' B' ' 34' ' ' LEU . 74.3 mt -63.02 4.52 0.18 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -60.73 -59.04 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 179.49 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.4 pttp -85.76 -9.02 57.76 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.392 178.88 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.594 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 10.7 mtp -88.37 -23.46 23.37 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.944 179.48 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -101.35 -60.62 1.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.567 -179.796 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.6 mtp-105 -63.5 -68.08 0.37 Allowed 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 111.549 -179.716 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.41 -34.16 15.69 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.48 179.909 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.594 ' HB2' ' O ' ' A' ' 18' ' ' MET . 6.6 mm-40 -81.32 -28.2 34.68 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.08 -179.961 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.487 ' O ' ' HB3' ' A' ' 24' ' ' LEU . . . 97.91 68.92 0.95 Allowed Glycine 0 C--N 1.339 0.724 0 C-N-CA 120.394 -0.907 . . . . 0.0 113.135 179.505 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.818 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER 177.02 -178.49 0.17 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.153 0.501 . . . . 0.0 111.748 178.146 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.491 ' N ' HD23 ' A' ' 24' ' ' LEU . 0.7 OUTLIER -110.69 166.88 10.66 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.865 -178.696 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -38.11 -43.29 0.73 Allowed 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -179.271 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.623 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 4.4 m -78.45 -53.39 7.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.733 0.242 . . . . 0.0 111.295 -179.27 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.609 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mt-10 -64.37 -15.2 60.0 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 110.023 178.605 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.697 ' HB2' HD21 ' A' ' 24' ' ' LEU . 2.5 tpt -77.09 -46.93 21.92 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.245 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.098 HG21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.0 -25.92 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.788 0 CA-C-N 112.834 -1.985 . . . . 0.0 112.716 -178.586 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.562 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.44 -51.25 58.87 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.674 0.749 . . . . 0.0 109.241 177.395 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.562 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 12.3 p -66.97 -31.69 54.59 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.679 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.56 -177.866 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.742 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -44.9 -34.07 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.32 177.406 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.808 HD13 HD21 ' B' ' 15' ' ' LEU . 8.8 mt -95.75 -24.92 16.28 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -177.769 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -69.69 -39.76 76.76 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.858 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.742 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -64.12 -34.73 78.71 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.237 0.926 . . . . 0.0 110.225 178.247 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.651 ' CD1' ' N ' ' A' ' 38' ' ' LYS . 0.9 OUTLIER -48.83 141.71 7.16 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.076 -179.629 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.651 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 177.193 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 120.899 0.38 . . . . 0.0 111.571 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -79.42 133.79 36.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.859 179.603 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.847 HD22 HD22 ' A' ' 12' ' ' LEU . 2.2 tp -133.41 144.85 49.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.516 -178.647 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.923 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.3 OUTLIER -128.92 130.3 46.61 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.71 179.077 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 1.098 HD12 HG21 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -150.34 -173.86 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.579 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.623 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 67.0 t-105 -97.91 101.6 13.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.485 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.902 HD11 ' CG2' ' A' ' 30' ' ' ILE . 1.6 mm? -128.27 107.0 9.41 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.499 178.113 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.713 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 11.1 p -79.99 -172.95 3.66 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 121.508 0.671 . . . . 0.0 112.103 -178.492 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -48.96 -58.07 5.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.967 -179.55 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -50.48 -30.79 13.59 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.021 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.663 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 44.2 p -87.57 -34.7 18.47 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.776 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' B' ' 8' ' ' SER . 50.2 mt -68.58 -39.82 80.8 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 178.394 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.11 -41.52 94.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.53 -1.668 . . . . 0.0 108.365 176.496 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.663 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.3 OUTLIER -52.57 -46.44 66.87 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.086 179.036 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.808 HD21 HD13 ' A' ' 34' ' ' LEU . 23.9 mt -77.34 32.31 0.15 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.97 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -105.64 -55.7 2.29 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.226 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -82.13 -24.77 34.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.465 179.214 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.706 ' HE2' HD23 ' B' ' 15' ' ' LEU . 8.0 mtm -85.08 -14.49 47.04 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.688 0.28 . . . . 0.0 110.451 179.294 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.841 ' HA ' HD21 ' B' ' 24' ' ' LEU . . . -99.92 -65.51 0.96 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.026 -179.891 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 22.3 mtp85 -58.56 -63.54 1.25 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.044 0.449 . . . . 0.0 111.502 -179.146 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.46 -34.75 17.59 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.549 179.381 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' B' ' 18' ' ' MET . 3.2 mm-40 -73.22 -28.64 62.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.145 178.907 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.65 -15.67 37.82 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.332 179.663 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.841 HD21 ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -90.64 -172.51 3.42 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.197 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.1 p -114.28 170.73 8.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.699 -179.883 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 3.1 mttm -44.64 -39.77 5.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.428 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.62 ' O ' HD11 ' A' ' 7' ' ' LEU . 13.2 m -71.94 -62.03 1.57 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.483 0.182 . . . . 0.0 110.906 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.669 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.6 mm-40 -57.95 -17.05 14.54 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.132 179.353 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.743 ' HE3' ' CG2' ' B' ' 32' ' ' VAL . 1.3 tpt -78.07 -45.78 22.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 123.601 1.667 . . . . 0.0 107.565 177.466 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.91 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -67.73 -18.76 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.789 0 CA-C-N 112.845 -1.98 . . . . 0.0 112.21 -177.987 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.71 -44.96 16.37 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.67 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.807 ' HB ' ' CD2' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -60.41 -32.28 50.73 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.659 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 1.02 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -35.74 -40.04 0.17 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 113.656 -1.611 . . . . 0.0 110.967 178.325 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 15' ' ' LEU . 4.0 mt -94.72 -28.38 15.34 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.259 -179.216 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 35' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' B' ' 32' ' ' VAL . 57.0 mt-30 -83.14 -30.13 28.1 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -179.375 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 1.02 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -94.3 19.43 9.48 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 117.909 0.322 . . . . 0.0 111.654 179.446 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.731 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -56.48 129.51 41.04 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -179.721 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.701 ' N ' ' HD1' ' B' ' 37' ' ' TYR . 1.4 mmmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 117.824 -1.084 . . . . 0.0 111.38 176.277 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 111.471 0.175 . . . . 0.0 111.471 . . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -80.58 113.13 18.56 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.465 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.417 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -122.95 141.33 52.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.058 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.63 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -116.96 128.73 55.49 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.975 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.86 HG13 HD21 ' A' ' 7' ' ' LEU . 1.9 pt -151.57 178.51 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.095 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -91.07 89.79 7.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -177.481 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.86 HD21 HG13 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -120.36 102.54 8.54 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.86 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.2 p -67.62 -140.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -177.061 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.406 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.6 t70 -95.28 -38.86 10.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.507 -178.011 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -72.55 39.45 0.08 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.946 0.498 . . . . 0.0 112.039 -179.153 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.841 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -163.59 -43.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.18 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 7' ' ' LEU . 56.6 mt -68.12 -41.26 81.97 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.214 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.05 -38.46 90.91 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 113.416 -1.72 . . . . 0.0 107.917 176.07 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.841 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -51.78 -42.72 62.63 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.996 178.331 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.07 HD21 HD13 ' B' ' 34' ' ' LEU . 50.3 mt -73.31 -12.7 60.93 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.744 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.83 -42.31 71.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.62 0.247 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -92.93 -20.94 20.12 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.717 179.325 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.916 ' HE2' HD23 ' A' ' 15' ' ' LEU . 30.9 mtm -87.21 -61.31 1.75 Allowed 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -179.3 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 1.016 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -25.18 -34.5 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 114.214 1.191 . . . . 0.0 114.214 -178.48 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 18' ' ' MET . 31.3 mmm-85 -70.21 -113.88 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.797 179.643 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 mmm-85 -55.38 -24.42 29.69 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 122.703 0.401 . . . . 0.0 111.875 179.669 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 26.8 mm-40 -103.63 -19.57 14.3 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -177.85 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 1.037 ' C ' HD13 ' A' ' 24' ' ' LEU . . . -115.36 -9.56 12.9 Favored Glycine 0 C--N 1.341 0.859 0 C-N-CA 119.127 -1.511 . . . . 0.0 114.624 -178.074 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.037 HD13 ' C ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER 44.21 32.43 0.68 Allowed 'General case' 0 CA--C 1.556 1.195 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 177.508 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.697 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 1.9 t 131.68 163.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 127.707 2.403 . . . . 0.0 109.495 177.904 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 26' ' ' LYS . 5.4 mtpt -69.24 -48.18 62.64 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.577 179.824 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.412 ' CB ' ' H ' ' B' ' 6' ' ' TRP . 9.6 m -77.95 -30.77 50.56 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.261 178.101 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.896 ' HB3' ' CD2' ' A' ' 24' ' ' LEU . 2.6 mm-40 -73.31 -28.47 62.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.743 179.091 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.974 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.4 tpt -67.87 -46.08 72.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 123.759 1.742 . . . . 0.0 107.896 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.083 HG22 HD11 ' B' ' 7' ' ' LEU . 0.4 OUTLIER -65.75 -18.45 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.037 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.845 -179.371 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -50.33 11.35 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.144 177.084 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.848 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -55.4 -34.47 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 178.562 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 1.007 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -35.56 -46.56 0.41 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.558 -1.655 . . . . 0.0 111.556 178.056 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.998 HD13 ' CD2' ' B' ' 15' ' ' LEU . 6.2 mt -83.5 -32.82 25.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.868 -179.092 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -81.05 -11.74 59.46 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 179.478 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 1.007 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -123.29 -4.93 8.34 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -179.529 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.615 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.7 OUTLIER -62.6 142.17 58.15 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.847 0.459 . . . . 0.0 110.52 179.88 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.863 -1.065 . . . . 0.0 112.262 178.763 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.55 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -73.81 127.3 32.45 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.048 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.1 tp -134.48 137.82 44.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.629 -178.869 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.63 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -111.07 128.54 55.91 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.804 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.995 ' CD1' HG21 ' A' ' 30' ' ' ILE . 4.0 pt -150.62 176.19 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.446 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.577 ' C ' HD22 ' B' ' 7' ' ' LEU . 74.5 t-105 -94.58 104.12 16.06 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.612 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 1.083 HD11 HG22 ' A' ' 30' ' ' ILE . 1.3 mm? -124.08 115.48 21.24 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 176.976 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 28.0 p -73.86 -135.91 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.637 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 9' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 12.9 t70 -96.49 -39.79 9.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -177.755 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -72.29 41.31 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.72 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.645 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 4.7 t -160.57 -44.49 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.307 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.415 HD21 ' HB2' ' B' ' 7' ' ' LEU . 17.6 mt -73.79 -41.9 61.74 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.677 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' B' ' 9' ' ' ASP . 1.9 mt-10 -76.32 -37.98 56.63 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 113.555 -1.657 . . . . 0.0 108.366 176.472 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.645 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -48.8 -32.14 8.21 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.227 178.304 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.998 ' CD2' HD13 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -82.13 32.89 0.39 Allowed 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 124.654 1.182 . . . . 0.0 112.923 179.906 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.557 ' HG2' ' N ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -81.84 -41.92 20.37 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.995 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 17' ' ' LYS . . . . . 0.557 ' N ' ' HG2' ' B' ' 16' ' ' GLU . 24.0 mtpp -115.59 24.07 11.85 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.626 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.7 ' SD ' HD22 ' B' ' 15' ' ' LEU . 35.6 mtp -110.83 -75.53 0.62 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.397 0.141 . . . . 0.0 111.356 -179.831 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.975 ' HB2' ' CD1' ' B' ' 15' ' ' LEU . . . -25.46 -32.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.865 1.666 . . . . 0.0 114.131 -177.913 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' B' ' 18' ' ' MET . 0.0 OUTLIER -62.5 -141.46 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.476 -0.489 . . . . 0.0 109.699 177.944 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 21' ' ' ARG . . . . . 0.468 ' N ' ' CG ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -43.43 -21.94 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.577 -0.702 . . . . 0.0 112.279 179.043 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' B' ' 20' ' ' ARG . 19.5 mm-40 -104.42 -12.93 16.28 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -177.769 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 0.731 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -137.71 12.26 3.69 Favored Glycine 0 CA--C 1.501 -0.79 0 C-N-CA 116.804 -2.617 . . . . 0.0 116.962 -175.713 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' B' ' 19' ' ' ALA . 1.1 mp 53.55 -161.97 0.12 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 119.723 1.762 . . . . 0.0 112.622 177.038 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -64.14 158.85 21.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.438 178.895 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.48 -43.14 11.37 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 117.624 0.193 . . . . 0.0 111.509 -179.608 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -82.69 -50.28 8.89 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.883 -0.144 . . . . 0.0 111.078 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.48 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.2 mm-40 -54.07 -30.12 46.91 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.799 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.867 ' SD ' HD21 ' B' ' 15' ' ' LEU . 3.5 tpt -60.39 -47.58 85.45 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 122.82 1.295 . . . . 0.0 109.821 177.603 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.737 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -79.28 -29.47 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.43 0 CA-C-N 112.407 -2.179 . . . . 0.0 114.056 -175.341 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.58 -48.16 56.64 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.297 1.046 . . . . 0.0 108.931 177.079 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 2.1 t -58.96 -47.07 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.469 -179.304 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.873 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -45.18 -34.81 2.91 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.804 179.686 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 1.07 HD13 HD21 ' A' ' 15' ' ' LEU . 13.6 mt -83.78 -30.46 26.58 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.398 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -80.36 -9.19 59.74 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.951 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -120.43 25.86 9.54 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 120.71 0.29 . . . . 0.0 111.153 177.961 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.596 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 22.1 t80 -132.96 163.55 28.94 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.744 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.595 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.5 tppt? . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.137 178.757 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.211 0.053 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -79.69 120.17 23.63 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.998 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.479 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.7 mm? -131.48 153.63 49.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.494 -178.995 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.894 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -126.65 127.56 45.37 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.329 178.829 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.838 HD11 HG21 ' B' ' 30' ' ' ILE . 2.7 pt -145.32 176.49 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.446 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.483 ' C ' HD22 ' A' ' 7' ' ' LEU . 73.3 t-105 -96.2 95.06 7.87 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.156 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.799 HD21 HD12 ' A' ' 5' ' ' ILE . 1.3 mm? -124.9 108.23 11.69 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.298 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.0 p -72.37 -136.79 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.535 0.207 . . . . 0.0 111.07 -178.867 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.681 ' O ' HG22 ' A' ' 11' ' ' THR . 1.7 t70 -88.14 -156.46 0.36 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 119.798 -0.144 . . . . 0.0 110.932 -179.535 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.15 44.1 0.09 Allowed 'General case' 0 C--N 1.346 0.413 0 C-N-CA 123.229 0.611 . . . . 0.0 112.089 179.24 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.697 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 7.8 t -172.65 -46.45 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.714 179.673 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.741 HD21 ' HB2' ' A' ' 7' ' ' LEU . 34.5 mt -73.57 -42.58 61.44 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 175.774 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.96 -39.61 83.34 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 113.323 -1.762 . . . . 0.0 107.081 175.657 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.697 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.9 t70 -49.46 -30.69 8.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.015 -1.448 . . . . 0.0 110.415 178.581 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.988 HD21 HD13 ' B' ' 34' ' ' LEU . 45.6 mt -73.51 22.73 0.07 Allowed 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.703 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -83.85 -66.1 0.93 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 122.17 -0.332 . . . . 0.0 110.551 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.75 -15.22 60.3 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.712 179.528 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.792 ' CE ' HD23 ' A' ' 15' ' ' LEU . 15.7 mtm -87.1 -27.37 23.16 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.37 -179.861 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.82 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -102.13 -59.38 1.71 Allowed 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.354 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.15 -62.21 1.93 Allowed 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 120.902 0.382 . . . . 0.0 111.601 -179.171 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.52 -36.15 22.36 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.513 179.439 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 18' ' ' MET . 12.1 mm-40 -76.21 -26.89 56.55 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.467 179.03 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.23 -12.85 61.93 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.18 -0.533 . . . . 0.0 112.359 -179.177 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.85 HD21 ' HB2' ' A' ' 29' ' ' MET . 0.0 OUTLIER -85.14 178.95 7.35 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.922 0.391 . . . . 0.0 111.9 -179.466 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.657 ' N ' HD23 ' A' ' 24' ' ' LEU . 19.3 p -113.76 169.6 8.87 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.779 -178.655 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.533 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -37.48 -42.4 0.51 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -179.385 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.692 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 29.2 p -72.42 -62.46 1.43 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.363 0.265 . . . . 0.0 111.586 -179.644 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mm-40 -58.56 -13.16 5.04 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.594 179.074 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.85 ' HB2' HD21 ' A' ' 24' ' ' LEU . 2.6 tpt -82.39 -48.25 11.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 122.736 1.255 . . . . 0.0 108.302 178.311 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.702 HD13 HD21 ' B' ' 34' ' ' LEU . 0.6 OUTLIER -74.51 -36.24 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.106 0 CA-C-N 112.806 -1.997 . . . . 0.0 112.916 -177.696 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -47.04 81.37 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.136 0.969 . . . . 0.0 108.75 176.864 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.96 -42.3 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 113.239 -1.801 . . . . 0.0 111.422 -179.584 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.746 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.82 -42.27 58.26 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.443 179.622 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.877 HD13 HD23 ' B' ' 15' ' ' LEU . 9.4 mt -73.76 -34.32 64.65 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.617 -178.037 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -74.46 -13.57 60.72 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -107.85 -40.1 5.36 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 177.983 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.623 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.4 t80 -29.33 133.02 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.038 0.535 . . . . 0.0 111.963 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.058 178.147 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 1' ' ' ARG . . . . . 0.475 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 . . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -78.97 122.37 26.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 178.963 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 3' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -130.57 152.5 49.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.334 -179.271 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 4' ' ' CYS . . . . . 0.894 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -125.67 128.31 47.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.532 178.956 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.492 ' CD1' HG21 ' A' ' 30' ' ' ILE . 2.3 pp -151.21 169.45 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-O 121.037 0.446 . . . . 0.0 112.118 -178.801 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.692 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 68.4 t-105 -81.19 90.51 6.08 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.74 0.781 . . . . 0.0 111.29 -179.594 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.637 ' HG ' HG23 ' B' ' 11' ' ' THR . 12.7 tp -107.17 95.39 5.68 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 178.537 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.57 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 6.0 p -81.34 -157.94 0.19 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.96 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -66.08 -41.57 90.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.913 -178.125 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -74.33 42.28 0.15 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.147 0.499 . . . . 0.0 111.346 -179.54 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 11' ' ' THR . . . . . 0.722 ' OG1' HD12 ' A' ' 34' ' ' LEU . 9.5 t -167.83 -43.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -179.822 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 12' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' B' ' 8' ' ' SER . 28.1 mt -69.9 -41.65 74.41 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.26 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 13' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' B' ' 16' ' ' GLU . 2.7 mt-10 -73.97 -41.35 62.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.37 -1.741 . . . . 0.0 108.187 176.582 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 14' ' ' ASP . . . . . 0.639 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -49.07 -27.31 3.25 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.091 178.519 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 1.033 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.57 40.56 0.59 Allowed 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 124.134 0.974 . . . . 0.0 112.385 179.883 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' B' ' 13' ' ' GLU . 7.1 mt-10 -74.59 -66.82 0.69 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.475 179.823 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -107.89 33.39 4.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.231 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 18' ' ' MET . . . . . 0.643 ' HB2' HD13 ' B' ' 15' ' ' LEU . 3.2 mtm -105.36 -84.52 0.5 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 122.322 -0.236 . . . . 0.0 110.684 179.679 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.758 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -48.49 -49.27 36.45 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.26 0.624 . . . . 0.0 111.693 179.873 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -61.33 -65.4 0.7 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.156 0.503 . . . . 0.0 111.26 -179.639 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -32.52 27.79 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.28 179.368 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 22' ' ' GLU . . . . . 0.527 ' HB2' ' O ' ' B' ' 18' ' ' MET . 18.5 mm-40 -91.22 -6.8 52.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.22 4.45 68.54 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.295 -0.955 . . . . 0.0 111.666 -178.03 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 24' ' ' LEU . . . . . 0.758 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.1 mt -78.92 169.48 18.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.501 0.667 . . . . 0.0 111.174 179.911 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 92.5 p -112.24 161.06 17.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.477 178.036 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.38 -37.14 0.96 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.48 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.5 m -83.26 -58.12 2.97 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.644 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -59.09 -13.85 8.2 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.496 178.944 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 29' ' ' MET . . . . . 1.033 ' SD ' HD11 ' B' ' 15' ' ' LEU . 3.3 tpt -80.76 -47.17 14.3 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 122.679 1.228 . . . . 0.0 108.494 178.059 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.838 HG21 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -75.94 -28.97 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.206 0 CA-C-N 112.794 -2.003 . . . . 0.0 113.219 -177.319 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.575 HD21 HG21 ' A' ' 11' ' ' THR . 0.3 OUTLIER -68.2 -48.55 64.9 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 122.329 1.062 . . . . 0.0 108.668 177.105 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.97 -48.28 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.577 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.794 -179.533 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 33' ' ' ALA . . . . . 0.762 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -47.76 -38.49 15.61 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.49 179.051 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.988 HD13 HD21 ' A' ' 15' ' ' LEU . 11.6 mt -74.67 -31.07 61.81 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.957 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -82.69 -13.82 55.7 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.111 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -124.78 21.66 8.3 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.786 0.327 . . . . 0.0 111.4 177.889 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.558 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 0.6 OUTLIER -81.1 131.79 35.32 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.66 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.458 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.121 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 178.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.991 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 120.982 0.42 . . . . 0.0 111.968 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -96.0 118.99 33.7 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 4.5 tp -118.54 134.84 54.78 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.228 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.762 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -124.46 127.57 47.69 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.085 178.535 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.821 ' CD1' HG21 ' B' ' 30' ' ' ILE . 1.1 pt -152.91 -176.51 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.749 ' O ' HD13 ' A' ' 7' ' ' LEU . 71.4 t-105 -97.03 93.15 6.42 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -177.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.902 HD11 HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -128.04 109.34 11.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 177.392 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.749 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 9.1 p -79.13 -176.29 5.05 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -43.39 -59.12 2.25 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 113.769 -1.559 . . . . 0.0 112.992 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -47.43 -26.25 1.29 Allowed 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.625 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 21.9 p -101.25 -29.41 12.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 8' ' ' SER . 43.6 mt -73.54 -40.68 63.79 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 178.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.99 -40.71 94.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.551 175.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.625 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -52.8 -48.22 67.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.282 -1.326 . . . . 0.0 109.282 178.131 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.95 HD21 HD13 ' B' ' 34' ' ' LEU . 15.6 mt -71.61 9.92 0.76 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.473 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -102.53 -48.62 4.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.561 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.473 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 30.3 mttm -72.25 -40.8 67.43 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.017 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.708 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 43.4 mtm -68.97 -63.81 0.99 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.714 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.651 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -47.46 -49.48 25.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.745 0.418 . . . . 0.0 111.676 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' GLU . 15.9 mtp85 . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 121.013 0.435 . . . . 0.0 111.627 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 95.5 mt . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 121.632 0.73 . . . . 0.0 111.561 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 m -114.01 166.05 11.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.335 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.9 -40.1 1.3 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.625 ' HA ' HD12 ' B' ' 5' ' ' ILE . 1.5 m -84.13 -54.2 4.99 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 111.532 0.197 . . . . 0.0 111.532 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.54 ' HB3' HD22 ' A' ' 24' ' ' LEU . 2.3 mm-40 -61.69 -10.74 9.31 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 120.722 0.296 . . . . 0.0 111.063 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.889 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.6 tpt -83.59 -47.32 11.41 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.69 1.233 . . . . 0.0 107.719 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.027 HG21 HD11 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -74.5 -31.53 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 CA-C-N 113.114 -1.857 . . . . 0.0 113.397 -178.167 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.431 ' OD1' HG21 ' B' ' 11' ' ' THR . 0.1 OUTLIER -65.54 -46.9 77.78 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.414 1.102 . . . . 0.0 108.555 177.201 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.402 ' N ' HD22 ' A' ' 31' ' ' ASN . 2.2 t -58.97 -47.37 90.03 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.595 0 CA-C-N 112.752 -2.022 . . . . 0.0 111.048 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.686 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -48.8 -37.69 19.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.29 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.1 HD13 HD21 ' B' ' 15' ' ' LEU . 13.4 mt -77.98 -29.74 49.86 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.973 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -79.47 -16.14 56.59 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -125.44 14.98 8.26 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.499 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.4 OUTLIER -71.64 137.7 48.1 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.182 0 C-N-CA 123.383 0.673 . . . . 0.0 112.259 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.749 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.5 mpt_? . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.808 0.337 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -99.56 119.83 38.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.602 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.9 tp -130.95 135.03 47.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.412 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.762 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -117.88 128.84 55.22 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.027 HD11 HG21 ' A' ' 30' ' ' ILE . 4.6 pt -147.77 178.65 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.505 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.8 t-105 -99.75 103.14 14.77 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -176.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.77 HD11 HG22 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -126.23 118.97 26.25 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 177.084 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 1.013 ' C ' HD23 ' B' ' 12' ' ' LEU . 0.3 OUTLIER -84.06 -161.49 0.55 Allowed 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.857 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . 0.673 ' O ' HG22 ' B' ' 11' ' ' THR . 2.6 p-10 -61.53 -168.6 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.359 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . 0.517 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.9 tt0 37.65 41.59 0.32 Allowed 'General case' 0 C--N 1.345 0.373 0 C-N-CA 123.456 0.702 . . . . 0.0 112.771 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.673 HG22 ' O ' ' B' ' 9' ' ' ASP . 11.5 t 177.32 -51.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.83 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 1.013 HD23 ' C ' ' B' ' 8' ' ' SER . 0.5 OUTLIER -67.49 -30.46 70.16 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 176.32 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.417 ' HG2' ' HG ' ' B' ' 12' ' ' LEU . 2.1 mm-40 -91.85 -38.64 12.21 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.424 177.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.655 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.1 t70 -44.39 -27.04 0.39 Allowed 'General case' 0 C--N 1.342 0.259 0 CA-C-N 114.438 -1.256 . . . . 0.0 111.045 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.1 HD21 HD13 ' A' ' 34' ' ' LEU . 33.2 mt -70.75 25.2 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 31.9 mt-10 -101.64 -55.75 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -75.18 -23.38 57.69 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.355 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.902 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 19.2 mtm -87.14 -22.28 25.44 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.102 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.761 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.72 -66.42 0.92 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.252 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.9 mtt-85 -58.13 -65.1 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.978 0.418 . . . . 0.0 111.854 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.11 -33.26 18.15 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.275 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.514 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.6 mm-40 -87.39 -9.41 54.84 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.423 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.14 -8.26 77.36 Favored Glycine 0 C--N 1.339 0.696 0 C-N-CA 120.705 -0.759 . . . . 0.0 111.762 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.761 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 78.1 mt -72.14 174.89 6.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.541 0.686 . . . . 0.0 111.495 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.5 p -120.2 166.04 13.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.547 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.558 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -43.97 -39.45 4.07 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.362 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m -83.82 -53.08 5.87 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 121.996 0.119 . . . . 0.0 111.205 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.33 -7.37 6.18 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.716 0.294 . . . . 0.0 110.737 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.902 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.4 tpt -87.09 -48.56 7.98 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 122.632 1.206 . . . . 0.0 107.968 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.902 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -75.81 -36.75 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.08 0 CA-C-N 112.988 -1.915 . . . . 0.0 112.926 -177.81 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.43 -46.17 87.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.313 1.054 . . . . 0.0 108.585 177.129 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.42 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -60.07 -44.68 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 CA-C-N 112.919 -1.946 . . . . 0.0 110.759 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.709 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -51.11 -39.48 56.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.352 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.95 HD13 HD21 ' A' ' 15' ' ' LEU . 12.9 mt -73.28 -30.34 63.35 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.318 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -76.5 -19.47 57.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -129.73 20.44 5.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.686 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -72.8 134.11 44.78 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.727 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 2.3 mmpt? . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.453 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.84 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.783 0.325 . . . . 0.0 111.479 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.53 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 98.1 m95 -70.85 163.96 26.28 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.635 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.9 tp -163.74 142.99 8.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.501 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.794 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -123.79 134.59 53.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.699 178.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.765 HD11 HG21 ' B' ' 30' ' ' ILE . 1.8 pt -150.05 179.3 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.45 ' C ' HD22 ' A' ' 7' ' ' LEU . 76.9 t-105 -95.9 92.66 6.62 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.887 HD11 HG22 ' B' ' 30' ' ' ILE . 1.5 mm? -122.91 114.61 20.68 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.755 ' O ' HD23 ' A' ' 12' ' ' LEU . 27.0 p -72.68 -179.58 3.14 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.421 0.629 . . . . 0.0 110.27 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.489 ' O ' HG22 ' A' ' 11' ' ' THR . 3.8 p-10 -60.55 -160.48 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.379 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.523 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.87 43.27 0.27 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 123.634 0.773 . . . . 0.0 113.006 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.698 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t 177.44 -50.28 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.64 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.89 HD21 ' HD2' ' B' ' 1' ' ' ARG . 0.7 OUTLIER -70.84 -30.79 67.3 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -89.24 -37.93 14.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.566 -1.652 . . . . 0.0 107.936 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.698 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -50.61 -17.42 0.51 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.335 -1.302 . . . . 0.0 111.156 178.639 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.012 HD21 HD13 ' B' ' 34' ' ' LEU . 49.1 mt -69.04 25.75 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 179.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -97.94 -54.27 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.32 -21.47 62.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.282 179.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.952 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 8.6 mtm -90.77 -23.05 20.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.709 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.723 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -101.13 -64.77 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.545 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 . . . . . 0 N--CA 1.469 0.5 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.146 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.723 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.9 mt . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 121.582 0.706 . . . . 0.0 111.485 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.5 p -117.57 168.18 10.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.455 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.553 ' NZ ' HD11 ' B' ' 3' ' ' LEU . 4.5 mmmm -46.39 -39.77 10.97 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.63 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 2.3 m -84.56 -52.34 6.2 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.132 0.173 . . . . 0.0 111.408 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.442 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.3 mm-40 -62.55 -7.28 4.39 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.7 0.286 . . . . 0.0 110.738 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.952 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.8 tpt -87.1 -48.5 8.03 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 122.657 1.218 . . . . 0.0 107.97 177.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.118 HG21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -76.12 -37.94 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.981 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.911 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.437 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -62.92 -45.22 93.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 122.335 1.064 . . . . 0.0 108.604 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -62.23 -42.9 97.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 112.85 -1.977 . . . . 0.0 111.328 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.723 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.39 -35.39 28.04 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.521 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.027 HD13 HD21 ' B' ' 15' ' ' LEU . 15.3 mt -76.45 -31.11 57.65 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.35 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -77.68 -16.49 58.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -126.57 16.85 7.56 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.512 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.3 OUTLIER -70.51 137.75 50.46 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.128 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.848 -1.072 . . . . 0.0 112.265 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.89 ' HD2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 120.829 0.347 . . . . 0.0 111.487 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.83 156.66 39.05 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.015 0.436 . . . . 0.0 110.065 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.553 HD11 ' NZ ' ' A' ' 26' ' ' LYS . 4.8 tp -159.38 139.23 11.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.157 -178.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.794 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -122.8 133.94 54.43 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.218 179.439 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.118 HD12 HG21 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -154.79 -176.8 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.699 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.768 ' O ' HD13 ' B' ' 7' ' ' LEU . 70.6 t-105 -92.51 88.2 6.26 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 1.033 HD11 HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -127.33 96.62 4.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.84 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 31.0 p -65.94 179.93 0.82 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.882 0.849 . . . . 0.0 112.806 -177.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -50.62 -54.14 25.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.337 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -49.82 -26.14 3.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.583 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 25.3 p -90.97 -28.85 17.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' B' ' 8' ' ' SER . 21.1 mt -76.24 -39.35 54.72 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -60.21 -41.03 92.14 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 113.643 -1.617 . . . . 0.0 107.229 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.606 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -53.94 -40.2 66.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.906 178.231 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.027 HD21 HD13 ' A' ' 34' ' ' LEU . 39.2 mt -77.01 29.41 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.41 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 40.6 mt-10 -99.5 -61.18 1.4 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -74.34 -22.99 58.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.439 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.729 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.9 mtm -85.65 -21.61 28.32 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.845 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.91 -67.5 0.84 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.41 ' HE ' ' HA ' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -55.81 -63.04 1.3 Allowed 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.969 0.414 . . . . 0.0 111.558 -179.152 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.22 -33.95 9.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.513 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 18' ' ' MET . 13.7 mm-40 -76.22 -28.96 57.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.571 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 102.88 -12.41 56.2 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 121.201 -0.523 . . . . 0.0 113.012 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.845 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -87.86 -174.51 4.76 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -179.341 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.0 p -105.02 167.28 9.81 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.93 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' B' ' 29' ' ' MET . 0.4 OUTLIER -49.8 -37.8 31.7 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.469 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.45 ' O ' HD11 ' A' ' 7' ' ' LEU . 4.3 m -79.03 -55.88 4.8 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.411 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.9 mt-10 -56.36 -20.12 17.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.729 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.6 tpt -70.87 -46.68 62.21 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 122.61 1.195 . . . . 0.0 108.68 177.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.887 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -75.57 -31.55 23.47 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.298 0 CA-C-N 113.047 -1.888 . . . . 0.0 113.254 -177.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.533 ' OD1' HG21 ' A' ' 11' ' ' THR . 0.0 OUTLIER -65.78 -46.47 78.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 122.397 1.094 . . . . 0.0 108.339 176.318 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.408 ' N ' HD22 ' B' ' 31' ' ' ASN . 1.6 t -58.36 -44.69 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-N 112.711 -2.04 . . . . 0.0 111.142 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.73 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -51.08 -32.18 21.41 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.63 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.012 HD13 HD21 ' A' ' 15' ' ' LEU . 18.6 mt -79.2 -31.39 43.77 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.857 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -78.8 -16.3 57.32 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.0 m80 -124.99 16.88 8.53 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.487 ' CE1' ' HB2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -69.96 138.93 52.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.119 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.487 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.171 0 CA-C-O 118.83 -0.605 . . . . 0.0 111.902 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -98.57 105.63 17.8 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tp -125.54 139.25 53.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.712 -178.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 6.5 m -96.0 139.51 32.08 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 1.08 HD13 HG21 ' B' ' 30' ' ' ILE . 1.1 pp -152.12 174.06 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.125 0.488 . . . . 0.0 112.227 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.769 ' O ' HD13 ' A' ' 7' ' ' LEU . 70.8 t-105 -90.34 106.76 18.71 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -176.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.04 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -133.15 115.65 15.31 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.446 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.559 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.6 p -89.37 -173.77 4.13 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.494 0.664 . . . . 0.0 111.875 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -49.65 -58.01 6.1 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.025 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -50.86 -27.28 7.09 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.61 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 28.1 p -91.83 -31.23 15.8 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.205 0.816 . . . . 0.0 113.205 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 8' ' ' SER . 46.1 mt -72.17 -40.55 67.88 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.49 -41.2 98.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.079 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.61 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.16 -44.88 61.55 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.404 178.949 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.101 HD22 ' CG ' ' A' ' 29' ' ' MET . 22.9 mt -79.41 24.87 0.33 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -104.47 -58.81 1.83 Allowed 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -73.86 -32.03 63.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.425 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.561 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 43.1 mtm -74.09 -61.72 1.75 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.224 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.845 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -51.8 -48.38 63.87 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 . . . . . 0 CA--C 1.512 -0.512 0 CA-C-O 121.031 0.443 . . . . 0.0 111.218 -179.534 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.845 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 111.854 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.3 p -104.03 165.68 10.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.723 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.478 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 6.9 mttm -40.74 -41.39 1.53 Allowed 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.582 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 85.3 p -73.43 -59.3 2.78 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.326 0.108 . . . . 0.0 111.022 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.549 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 1.8 mm-40 -57.21 -22.07 38.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.176 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 1.101 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -71.67 -48.43 47.61 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.891 1.329 . . . . 0.0 108.751 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.903 HG21 HD13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -76.32 -31.74 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.266 0 CA-C-N 112.713 -2.039 . . . . 0.0 114.185 -176.588 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.443 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -70.17 -47.29 62.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 122.155 0.979 . . . . 0.0 109.797 178.383 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.549 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -65.02 -39.14 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-N 113.309 -1.768 . . . . 0.0 111.122 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.705 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -42.87 -61.56 1.24 Allowed 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.419 -1.264 . . . . 0.0 112.169 -179.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.864 ' HB3' ' HB2' ' B' ' 33' ' ' ALA . 0.0 OUTLIER -75.07 -28.69 60.45 Favored 'General case' 0 N--CA 1.432 -1.37 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.636 -177.019 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.858 ' N ' HD22 ' A' ' 34' ' ' LEU . 8.1 mt-30 -58.17 -20.22 39.18 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.333 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -120.41 25.09 10.02 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.2 0.524 . . . . 0.0 109.683 175.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.695 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -91.5 141.21 28.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.153 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.152 0 C-N-CA 123.471 0.708 . . . . 0.0 112.16 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 2.1 mpt_? . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.858 0.361 . . . . 0.0 111.679 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -109.98 109.27 19.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.475 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.4 tp -134.46 144.25 48.0 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.205 -178.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -96.46 137.1 36.04 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.903 HD13 HG21 ' A' ' 30' ' ' ILE . 4.4 pt -137.41 170.84 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.582 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 75.1 t-105 -100.31 106.81 18.47 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -177.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.784 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.7 OUTLIER -126.85 114.64 18.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.585 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 14.3 p -83.04 178.11 8.29 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.814 0.816 . . . . 0.0 112.13 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -51.7 -50.73 59.89 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.921 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -45.46 -35.68 3.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.474 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.819 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -104.7 -14.22 15.65 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' B' ' 8' ' ' SER . 94.1 mt -65.07 -39.25 92.97 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.13 -43.93 93.76 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 113.496 -1.684 . . . . 0.0 107.98 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.819 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -52.67 -40.29 62.74 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.545 178.839 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.743 HD22 ' CG ' ' B' ' 29' ' ' MET . 14.6 mt -77.95 28.96 0.17 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -104.16 -61.54 1.43 Allowed 'General case' 0 N--CA 1.461 0.11 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.51 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 16.6 mtpp -71.87 -21.74 61.61 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.345 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.795 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 25.7 mtm -90.22 -24.72 20.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.399 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.702 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -104.16 -64.38 1.11 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.515 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 10.7 mtp-105 -60.16 -65.74 0.63 Allowed 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 120.998 0.428 . . . . 0.0 111.69 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . 0.51 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -50.6 -33.43 22.06 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.421 179.826 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' B' ' 18' ' ' MET . 16.1 mm-40 -84.84 -11.18 56.22 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.174 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.08 -5.67 84.74 Favored Glycine 0 C--N 1.339 0.737 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.856 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.886 HD22 ' HB3' ' B' ' 28' ' ' GLU . 72.4 mt -75.49 175.58 8.36 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.568 0.699 . . . . 0.0 111.295 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 10.6 p -119.76 174.5 6.39 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.652 -1.158 . . . . 0.0 108.8 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.486 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.0 mttm -51.14 -29.54 13.84 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 111.687 0.254 . . . . 0.0 111.687 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.636 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 34.5 m -82.51 -60.58 2.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.529 0.332 . . . . 0.0 111.496 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.886 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.6 mt-10 -61.03 -9.19 4.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.221 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.795 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.9 tpt -86.58 -46.62 9.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 1.08 HG21 HD13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -75.22 -32.89 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 CA-C-N 113.042 -1.89 . . . . 0.0 113.282 -178.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.487 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -70.78 -50.37 36.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 122.119 0.961 . . . . 0.0 109.203 177.776 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.487 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -54.79 -40.31 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 CA-C-N 113.212 -1.813 . . . . 0.0 109.844 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.864 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . . . -44.44 -43.69 7.94 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.894 -1.503 . . . . 0.0 111.242 178.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.908 HD13 HD21 ' A' ' 15' ' ' LEU . 9.4 mt -78.54 -29.25 46.29 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.148 -177.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -70.66 -25.43 63.0 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -133.4 21.65 4.0 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.575 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -64.58 140.21 58.84 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 177.778 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.479 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.661 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.997 ' HD3' HD21 ' B' ' 12' ' ' LEU . 1.5 ttt-85 . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.35 118.57 25.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.545 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 mm? -131.46 148.92 52.69 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.436 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.869 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -117.04 128.6 55.32 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.673 ' CD1' HG21 ' B' ' 30' ' ' ILE . 2.4 pp -154.92 172.41 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.774 0.321 . . . . 0.0 111.387 -178.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.613 ' O ' ' HB2' ' B' ' 27' ' ' SER . 57.9 t-105 -79.56 78.21 6.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.553 0.692 . . . . 0.0 111.088 -179.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.026 HD11 HG21 ' A' ' 11' ' ' THR . 54.2 tp -115.54 76.14 0.99 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.755 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 24.3 p -76.1 -145.04 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.475 -177.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.13 -155.28 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.245 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.53 44.43 0.11 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.323 0.649 . . . . 0.0 112.299 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 1.026 HG21 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -178.5 -50.34 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.432 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.563 HD21 HD22 ' B' ' 3' ' ' LEU . 19.1 mt -70.17 -41.09 74.23 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 175.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -79.09 -39.78 32.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.037 -1.892 . . . . 0.0 108.323 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.759 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -50.6 -29.08 10.01 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.796 178.623 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.281 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -77.38 31.8 0.15 Allowed 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.217 1.007 . . . . 0.0 112.929 179.71 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -76.61 -59.81 2.61 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -96.71 13.13 29.45 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.706 ' HB2' HD13 ' A' ' 15' ' ' LEU . 8.5 mtm -102.08 -76.68 0.57 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.09 0.405 . . . . 0.0 111.271 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.904 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -26.39 -32.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 126.507 1.923 . . . . 0.0 114.377 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 31.4 mmm-85 . . . . . 0 C--N 1.307 -1.25 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.344 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.478 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 122.151 0.977 . . . . 0.0 112.953 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -65.09 167.57 7.82 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.171 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -43.05 64.19 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' B' ' 6' ' ' TRP . 23.7 p -83.81 -47.52 11.03 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.892 -0.14 . . . . 0.0 111.086 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -56.04 -30.5 62.0 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 1.281 ' SD ' HD11 ' A' ' 15' ' ' LEU . 4.7 tpt -59.83 -47.83 84.12 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 122.69 1.233 . . . . 0.0 109.952 177.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.105 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -79.34 -27.09 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.508 0 CA-C-N 112.828 -1.987 . . . . 0.0 114.099 -175.471 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.618 ' OD1' HG21 ' B' ' 11' ' ' THR . 0.0 OUTLIER -70.62 -48.68 53.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 122.286 1.041 . . . . 0.0 108.82 176.664 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.436 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 1.7 t -60.17 -46.19 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-N 112.986 -1.916 . . . . 0.0 111.553 -179.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.877 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -45.54 -40.6 8.84 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.236 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.97 HD21 ' HB2' ' B' ' 33' ' ' ALA . 11.4 mt -80.5 -28.8 37.39 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.245 -177.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -71.91 -13.94 61.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.509 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.6 m80 -129.83 46.25 2.68 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.572 0.225 . . . . 0.0 111.153 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.742 ' HA ' ' CD2' ' B' ' 36' ' ' HIS . 0.8 OUTLIER -60.46 132.12 52.89 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.312 0.577 . . . . 0.0 112.025 179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.633 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.9 mmmt . . . . . 0 C--O 1.249 1.066 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.889 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.755 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 121.028 0.442 . . . . 0.0 111.806 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.4 173.6 4.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.191 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.948 ' CD2' HD23 ' A' ' 7' ' ' LEU . 2.1 tp -173.4 150.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.738 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.869 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.9 OUTLIER -129.47 130.66 46.15 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.463 178.689 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.872 ' CD1' HG21 ' A' ' 30' ' ' ILE . 5.4 pt -144.47 176.66 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.499 ' C ' HD22 ' B' ' 7' ' ' LEU . 76.4 t-105 -103.05 98.4 8.35 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 1.105 HD11 HG22 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -125.55 126.98 45.68 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 175.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.509 ' O ' HD23 ' B' ' 12' ' ' LEU . 2.3 t -81.87 -150.46 0.08 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.141 -0.624 . . . . 0.0 109.496 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . 0.432 ' O ' HG22 ' B' ' 11' ' ' THR . 0.7 OUTLIER -87.56 -163.56 0.96 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . 0.443 ' O ' ' HB ' ' B' ' 11' ' ' THR . 2.2 tt0 35.77 39.14 0.06 Allowed 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.448 0.699 . . . . 0.0 112.309 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.682 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 1.9 t -176.57 -52.36 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.671 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.997 HD21 ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -67.93 -33.15 74.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.266 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.579 ' N ' HD12 ' B' ' 12' ' ' LEU . 29.6 mt-10 -96.41 -37.64 10.37 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.062 -1.426 . . . . 0.0 109.271 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.682 ' HB2' ' N ' ' B' ' 11' ' ' THR . 1.5 m-20 -56.7 -34.54 67.53 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.666 -178.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.925 HD12 ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.58 -5.02 30.28 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.504 ' N ' HD22 ' B' ' 15' ' ' LEU . 10.9 mm-40 -60.11 -46.95 87.91 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.334 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -55.56 -35.59 65.9 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.101 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.518 ' CE ' ' HB2' ' B' ' 15' ' ' LEU . 34.8 mtm -69.57 -59.8 2.73 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.105 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.763 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -36.41 -46.88 0.58 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.485 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 1.5 mmm-85 -67.7 -73.73 0.13 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -50.86 -29.99 13.32 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.59 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.478 ' HG3' ' HB3' ' B' ' 18' ' ' MET . 25.0 mm-40 -79.29 -27.65 42.24 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.688 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . 0.475 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 94.58 67.17 1.02 Allowed Glycine 0 C--N 1.341 0.83 0 C-N-CA 120.263 -0.97 . . . . 0.0 113.587 178.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.763 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 177.86 -176.74 0.19 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.099 0.476 . . . . 0.0 111.554 178.038 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . 0.472 ' N ' HD23 ' B' ' 24' ' ' LEU . 3.5 t -115.79 176.4 5.1 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.125 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.467 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.9 mttm -41.44 -39.53 1.53 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.613 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 26.6 p -73.3 -63.77 1.12 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.674 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.8 mm-40 -59.19 -18.6 37.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.799 ' HG2' ' CD2' ' B' ' 15' ' ' LEU . 1.1 tpt -74.55 -48.08 28.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 123.793 1.758 . . . . 0.0 107.494 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.916 HG22 HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.79 -23.26 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.82 0 CA-C-N 112.79 -2.005 . . . . 0.0 112.062 -178.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -85.17 -44.74 12.68 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.741 176.779 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.771 ' CG2' ' HE3' ' B' ' 29' ' ' MET . 4.4 m -52.39 -34.59 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-O 121.969 0.89 . . . . 0.0 109.211 178.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.97 ' HB2' HD21 ' A' ' 34' ' ' LEU . . . -37.72 -45.33 0.79 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.065 -1.879 . . . . 0.0 111.734 178.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.87 HD13 ' CD2' ' A' ' 15' ' ' LEU . 8.5 mt -83.01 -32.29 27.0 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.638 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . 0.416 HE22 ' CG ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -73.89 -21.18 60.18 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.873 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.922 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 8.0 p-80 -105.71 -27.84 11.07 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.653 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 12.5 t80 -52.06 149.21 5.33 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.003 0.365 . . . . 0.0 110.067 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.577 ' HD3' ' CE2' ' B' ' 37' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 123.342 0.657 . . . . 0.0 112.455 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.748 ' HD2' ' CD2' ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.727 0.299 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -70.91 128.5 36.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 110.301 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 5' ' ' ILE . 2.3 tp -123.93 135.75 53.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.609 -178.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.768 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -131.84 123.55 27.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.156 179.33 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.869 HD11 HD21 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -152.64 -173.79 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.096 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.617 ' C ' HD22 ' A' ' 7' ' ' LEU . 68.8 t-105 -91.82 92.21 8.28 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -177.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.019 HD11 HG22 ' B' ' 30' ' ' ILE . 2.0 mm? -129.56 103.37 6.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.642 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 28.4 p -66.3 -142.71 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 120.87 0.367 . . . . 0.0 111.515 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -97.46 -147.4 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.065 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.504 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.8 tt0 32.42 45.75 0.06 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.483 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.821 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.6 OUTLIER -172.53 -51.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.694 179.166 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.543 HD13 HD13 ' B' ' 3' ' ' LEU . 17.1 mt -72.19 -41.47 66.92 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -81.15 -38.79 26.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.59 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.821 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -42.83 -28.52 0.25 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-N 114.538 -1.21 . . . . 0.0 111.081 179.209 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.847 ' CD2' HD23 ' B' ' 34' ' ' LEU . 0.1 OUTLIER -65.24 9.0 0.12 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -53.56 -41.03 66.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -87.26 -24.63 24.3 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.75 ' HB2' HD12 ' A' ' 15' ' ' LEU . 4.1 mtm -97.75 -65.85 0.94 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.741 ' H ' HD12 ' A' ' 15' ' ' LEU . . . -33.9 -31.38 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 . . . . . 0 C--N 1.31 -1.136 0 C-N-CA 119.524 -0.87 . . . . 0.0 110.743 179.453 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.686 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 122.11 0.957 . . . . 0.0 113.192 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.461 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.1 p -62.51 159.34 15.91 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.341 -1.3 . . . . 0.0 109.468 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.46 -42.31 6.97 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.7 p -80.88 -40.97 23.87 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.686 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mm-40 -61.82 -28.39 69.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.125 -0.23 . . . . 0.0 110.757 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.841 ' SD ' HD21 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -67.11 -42.38 84.62 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-O 122.512 1.148 . . . . 0.0 108.567 177.586 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.653 HG22 ' CD1' ' B' ' 7' ' ' LEU . 0.3 OUTLIER -76.77 -35.04 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.365 0 CA-C-N 112.725 -2.034 . . . . 0.0 113.473 -175.474 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.461 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -63.97 -46.85 82.83 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -58.7 -41.27 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 CA-C-N 112.635 -2.075 . . . . 0.0 111.425 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.998 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -45.42 -41.16 8.95 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.696 -1.138 . . . . 0.0 112.119 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.887 HD22 HD21 ' B' ' 15' ' ' LEU . 7.0 mt -81.47 -29.87 33.57 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.961 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -71.67 -17.51 62.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 33.2 m80 -118.23 39.61 3.38 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.609 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 58.1 t80 -90.01 162.81 15.19 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.374 -178.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.557 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.271 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.642 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.978 0.418 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -75.82 138.45 41.16 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.963 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.543 HD13 HD13 ' A' ' 12' ' ' LEU . 2.2 tp -128.33 133.13 48.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.469 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.768 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -126.19 123.78 38.99 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.776 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.86 HG13 HD21 ' B' ' 7' ' ' LEU . 1.6 pt -154.29 175.69 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.441 ' O ' HD13 ' B' ' 7' ' ' LEU . 75.3 t-105 -88.57 96.13 10.51 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.86 HD21 HG13 ' B' ' 5' ' ' ILE . 1.1 mm? -119.5 118.93 32.39 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.734 ' O ' HD23 ' B' ' 12' ' ' LEU . 44.9 p -65.7 164.97 13.41 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.995 0.903 . . . . 0.0 111.165 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . 0.441 ' HA ' ' CD2' ' B' ' 12' ' ' LEU . 8.3 t70 -64.45 -37.9 89.16 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 113.633 -1.621 . . . . 0.0 112.924 -177.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -73.16 38.75 0.09 Allowed 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.806 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 7.9 t -174.17 -51.54 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.975 0.51 . . . . 0.0 111.877 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.748 ' CD2' ' HD2' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -57.54 -28.61 63.68 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 176.674 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 68.7 mm-40 -84.23 -38.9 19.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.393 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.806 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.2 t70 -44.14 -29.58 0.64 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.829 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.887 HD21 HD22 ' A' ' 34' ' ' LEU . 28.9 mt -79.4 27.07 0.27 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.425 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.1 OUTLIER -111.46 -52.18 2.8 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.247 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -76.93 -32.68 57.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 120.835 0.35 . . . . 0.0 110.597 178.812 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.467 ' HE3' ' CG ' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -97.25 20.64 11.14 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.111 179.32 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.91 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -100.03 -19.79 16.36 Favored 'General case' 0 C--O 1.214 -0.779 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.431 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 39.1 mmm-85 -65.67 -126.35 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.726 0 O-C-N 121.657 -0.652 . . . . 0.0 110.468 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -52.69 -22.85 5.64 Favored 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 121.681 -0.637 . . . . 0.0 110.439 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -93.64 -23.43 18.27 Favored 'General case' 0 CA--C 1.522 -0.127 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . 0.91 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -134.99 16.28 4.22 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 117.19 -2.433 . . . . 0.0 116.369 -177.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.733 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.0 OUTLIER 55.56 -166.18 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.653 1.226 . . . . 0.0 113.667 175.846 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.1 m -53.94 149.56 8.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.145 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -41.8 -46.44 3.9 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.621 ' O ' HD11 ' A' ' 7' ' ' LEU . 74.5 p -75.87 -44.13 42.19 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.652 0.263 . . . . 0.0 110.702 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.653 ' O ' HG22 ' B' ' 32' ' ' VAL . 3.6 mt-10 -54.78 -38.68 67.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.74 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.865 ' HE3' HG23 ' B' ' 32' ' ' VAL . 4.0 tpt -57.89 -47.21 83.45 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 123.623 1.678 . . . . 0.0 108.935 177.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 1.019 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -65.9 -21.45 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.667 0 CA-C-N 112.972 -1.922 . . . . 0.0 112.649 -178.099 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.582 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -83.53 -46.36 12.52 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 177.49 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.865 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -58.66 -30.3 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.062 0 CA-C-O 121.878 0.847 . . . . 0.0 109.009 177.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 1.001 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.15 -54.71 1.73 Allowed 'General case' 0 CA--C 1.495 -1.14 0 CA-C-N 113.599 -1.637 . . . . 0.0 108.729 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.103 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -67.44 -46.72 72.26 Favored 'General case' 0 N--CA 1.399 -2.976 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.243 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . 1.103 ' N ' HD13 ' B' ' 34' ' ' LEU . 4.6 mt-30 -64.21 -59.33 4.55 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 1.001 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.3 p80 -65.87 -16.41 63.81 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.728 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.8 OUTLIER -55.83 137.69 49.62 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.577 0.351 . . . . 0.0 110.298 178.682 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.474 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.067 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.82 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.775 0.322 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.482 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.5 m95 -78.95 165.76 23.12 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.427 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 tp -171.34 147.29 2.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.238 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.932 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -108.57 140.32 42.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.947 ' CD1' HG21 ' B' ' 30' ' ' ILE . 3.8 pt -147.92 176.64 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.715 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 76.6 t-105 -100.86 100.77 11.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.815 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.7 OUTLIER -131.18 114.62 15.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.77 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -88.54 -167.11 1.78 Allowed 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.422 0.63 . . . . 0.0 112.303 -178.209 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -50.85 -57.99 7.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.784 -1.098 . . . . 0.0 112.419 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.25 -29.55 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.623 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 69.8 p -95.26 -33.39 12.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 8' ' ' SER . 69.9 mt -67.94 -40.69 83.23 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 178.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -59.98 -43.91 94.81 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.749 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.623 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -57.06 -51.62 68.53 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.395 -1.275 . . . . 0.0 109.564 178.236 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.982 HD22 ' CG ' ' A' ' 29' ' ' MET . 14.8 mt -78.15 24.56 0.25 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.87 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.448 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -114.99 -52.96 2.67 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 178.454 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HG2' ' HG2' ' A' ' 16' ' ' GLU . 0.8 OUTLIER -87.49 -32.82 19.25 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 122.667 0.387 . . . . 0.0 110.782 178.522 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.752 ' HE1' ' HB2' ' B' ' 34' ' ' LEU . 0.5 OUTLIER -91.73 6.04 47.49 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.46 179.619 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -97.21 -15.53 20.81 Favored 'General case' 0 C--O 1.211 -0.928 0 C-N-CA 122.669 0.388 . . . . 0.0 111.737 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.429 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.785 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.73 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 122.341 1.067 . . . . 0.0 113.54 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.488 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.8 p -60.48 156.78 15.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.666 178.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.55 -40.15 2.56 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.447 ' OG ' HG22 ' B' ' 5' ' ' ILE . 29.3 m -79.68 -49.36 12.21 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.247 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.73 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.2 mm-40 -55.49 -30.41 60.57 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.387 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.982 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -61.01 -50.84 71.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.069 1.414 . . . . 0.0 108.767 177.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.011 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -71.81 -34.66 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.523 0 CA-C-N 112.929 -1.941 . . . . 0.0 114.133 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.25 -47.98 72.0 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.872 0.844 . . . . 0.0 109.092 177.284 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.534 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.12 -39.43 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-N 113.684 -1.598 . . . . 0.0 111.445 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.577 ' O ' ' HB1' ' B' ' 33' ' ' ALA . . . -47.56 -40.37 18.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.063 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.004 HD13 ' CD2' ' B' ' 15' ' ' LEU . 11.9 mt -78.51 -28.47 46.25 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.364 -177.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.418 ' HB3' HE21 ' A' ' 35' ' ' GLN . 0.0 OUTLIER -77.23 -18.83 57.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.6 m80 -104.75 -38.79 6.56 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.539 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 24.6 t80 -44.32 153.6 0.15 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.954 0.407 . . . . 0.0 111.966 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.522 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 9.3 mmmt . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.493 -0.765 . . . . 0.0 111.364 177.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.77 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.2 mpt_? . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.194 0.521 . . . . 0.0 111.861 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 74.4 m95 -114.66 105.04 12.59 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.468 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 1.5 tp -126.49 146.57 50.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.819 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.932 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -106.01 136.73 45.15 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.921 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.011 HD12 HG21 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -148.41 -177.57 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.403 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.666 ' O ' HD13 ' B' ' 7' ' ' LEU . 65.7 t-105 -92.28 90.13 7.14 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.907 HD11 HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -127.01 94.41 4.02 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.82 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 42.6 p -64.58 177.54 0.89 Allowed 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.79 0.805 . . . . 0.0 112.342 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -52.87 -50.07 64.54 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.196 -1.365 . . . . 0.0 111.67 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.0 -26.55 6.18 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.642 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 26.1 p -92.45 -25.65 18.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.455 HD11 ' HE ' ' A' ' 1' ' ' ARG . 22.7 mt -77.88 -40.71 39.12 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.72 -40.95 89.7 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 113.957 -1.474 . . . . 0.0 107.233 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.548 ' O ' ' HG3' ' B' ' 18' ' ' MET . 41.8 t0 -54.82 -39.22 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 114.016 -1.447 . . . . 0.0 110.276 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.004 ' CD2' HD13 ' A' ' 34' ' ' LEU . 32.1 mt -76.96 27.72 0.14 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.486 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 47.4 mt-10 -99.82 -54.46 2.9 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -77.48 -22.0 51.97 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.51 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.895 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 11.3 mtm -91.29 -24.21 19.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.944 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.713 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.32 -66.51 0.91 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.486 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -54.7 -67.82 0.24 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -179.419 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -31.44 11.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.405 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.504 ' HB2' ' O ' ' B' ' 18' ' ' MET . 15.9 mm-40 -87.95 -9.94 52.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.261 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.26 -3.39 86.25 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.855 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.713 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 87.3 mt -75.74 172.65 12.28 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.532 0.682 . . . . 0.0 111.6 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.4 p -115.47 163.4 15.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 mttm -42.16 -41.56 2.71 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.715 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 4.3 m -84.77 -50.5 7.53 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.626 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.5 mt-10 -64.49 -7.98 12.07 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.732 0.301 . . . . 0.0 110.245 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.947 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.0 tpt -85.37 -47.15 10.27 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 122.639 1.209 . . . . 0.0 108.028 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.947 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.4 OUTLIER -75.86 -40.96 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 112.971 -1.922 . . . . 0.0 113.141 -177.436 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -44.76 95.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.972 0.891 . . . . 0.0 109.658 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.626 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -70.49 -32.86 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 113.714 -1.585 . . . . 0.0 112.545 -179.208 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.729 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -54.7 -53.14 58.87 Favored 'General case' 0 CA--C 1.501 -0.916 0 CA-C-O 121.889 0.852 . . . . 0.0 110.163 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.934 HD22 HD21 ' A' ' 15' ' ' LEU . 4.0 pp -72.27 -25.52 61.63 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.744 -1.571 . . . . 0.0 112.033 -178.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . 0.713 ' N ' HD12 ' B' ' 34' ' ' LEU . 0.0 OUTLIER -66.94 -19.75 65.78 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.389 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 55.0 m80 -116.27 24.37 11.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 175.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -95.87 143.96 26.63 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.323 0.649 . . . . 0.0 110.124 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.499 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.724 -0.655 . . . . 0.0 112.225 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.776 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.071 0.462 . . . . 0.0 111.881 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -112.3 111.04 21.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.263 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -127.3 144.08 51.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.362 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.825 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -109.9 136.65 48.86 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.434 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.797 ' CD1' HD21 ' A' ' 7' ' ' LEU . 1.8 pt -150.08 176.82 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.465 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.3 t-105 -93.61 90.91 6.82 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -177.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.797 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.8 OUTLIER -124.64 104.14 8.52 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.558 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 6.9 t -78.77 -139.1 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -80.59 -160.09 0.28 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.258 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.41 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.9 tt0 35.07 45.07 0.16 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-O 121.538 0.685 . . . . 0.0 111.667 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.782 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.65 -52.33 0.02 OUTLIER 'General case' 0 C--O 1.23 0.079 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.893 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.576 HD11 ' O ' ' A' ' 7' ' ' LEU . 18.1 mt -73.93 -42.09 61.11 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -76.44 -39.37 53.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 113.125 -1.852 . . . . 0.0 108.207 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.782 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -45.16 -38.69 5.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.302 178.896 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.907 HD12 ' HB2' ' A' ' 19' ' ' ALA . 3.0 mm? -68.68 7.01 0.72 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -62.42 -39.81 94.51 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -102.09 -10.85 19.32 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.727 ' HB2' HD13 ' A' ' 15' ' ' LEU . 29.4 mtm -97.91 -66.11 0.92 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.907 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -36.87 -29.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 20.8 mmm-85 . . . . . 0 C--N 1.312 -1.058 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.437 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.506 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 122.029 0.919 . . . . 0.0 112.739 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -61.14 160.27 10.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.269 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.22 -39.29 13.79 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.679 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 69.5 m -79.04 -44.55 21.96 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.72 0.266 . . . . 0.0 111.72 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 9.8 mm-40 -61.72 -31.31 71.47 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.907 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.723 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.26 -38.8 92.34 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.771 1.272 . . . . 0.0 107.77 177.029 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.088 HG21 HD12 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -76.18 -17.98 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.97 0 CA-C-N 112.744 -2.025 . . . . 0.0 113.569 -176.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.532 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -73.18 -51.97 15.86 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.115 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.532 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 7.3 p -65.95 -28.46 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.441 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.798 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -41.97 -42.44 2.81 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.811 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.855 HD21 HD13 ' B' ' 30' ' ' ILE . 9.0 mt -84.49 -27.7 27.25 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.157 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.428 ' HB2' ' HA ' ' A' ' 32' ' ' VAL . 31.2 mt-30 -63.53 -32.58 74.08 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.798 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 14.0 p-80 -97.91 -38.11 9.54 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.339 0.518 . . . . 0.0 112.178 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.563 ' CG ' ' HA ' ' B' ' 33' ' ' ALA . 21.4 t80 -45.87 141.18 3.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.129 0 C-N-CA 123.678 0.791 . . . . 0.0 112.269 178.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.558 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 120.725 0.298 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -100.28 114.16 27.42 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 tp -133.07 145.4 50.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.643 -178.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.825 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -111.6 136.34 50.94 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.088 HD12 HG21 ' A' ' 30' ' ' ILE . 1.5 pt -147.04 -176.89 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.718 ' O ' HD13 ' B' ' 7' ' ' LEU . 71.0 t-105 -98.69 98.49 9.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.984 HD11 HG23 ' A' ' 30' ' ' ILE . 0.8 OUTLIER -131.14 108.8 9.99 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.575 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.776 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -92.52 -164.96 1.25 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.436 0.636 . . . . 0.0 112.053 -178.225 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -45.15 -62.57 1.2 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.513 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -50.79 -29.75 12.39 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.567 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 68.6 p -88.46 -34.74 17.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' B' ' 8' ' ' SER . 45.0 mt -69.95 -40.01 75.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -61.95 -41.92 98.53 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.783 -1.553 . . . . 0.0 107.736 175.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.567 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.4 OUTLIER -53.35 -49.43 67.15 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.003 178.516 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.891 HD22 ' CG ' ' B' ' 29' ' ' MET . 17.9 mt -73.76 8.38 1.97 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.74 -40.1 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.72 -26.59 29.62 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.822 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.0 mtm -86.23 -64.43 1.15 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.752 -0.204 . . . . 0.0 111.4 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.582 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -47.89 -43.94 29.12 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.683 0.393 . . . . 0.0 111.871 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.449 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 24.0 mmm-85 -61.01 -68.76 0.28 Allowed 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 111.597 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -31.64 37.25 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.95 179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.484 ' HB3' ' HG ' ' B' ' 24' ' ' LEU . 20.7 mm-40 -86.51 -10.47 54.04 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.289 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.15 14.22 68.21 Favored Glycine 0 C--N 1.341 0.809 0 C-N-CA 120.499 -0.858 . . . . 0.0 111.582 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.582 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 90.5 mt -86.8 166.77 14.97 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.56 0.695 . . . . 0.0 111.844 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 83.7 p -103.44 164.34 11.71 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.355 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -43.54 -35.98 1.89 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -179.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.59 -56.63 3.41 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.555 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.1 mt-10 -58.89 -15.34 12.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.612 0.244 . . . . 0.0 110.386 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.891 ' CG ' HD22 ' B' ' 15' ' ' LEU . 1.7 tpt -79.29 -48.1 14.72 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 122.6 1.19 . . . . 0.0 108.227 177.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.855 HD13 HD21 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.58 -33.89 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.037 0 CA-C-N 113.191 -1.822 . . . . 0.0 113.436 -177.36 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.408 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -67.65 -45.93 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.798 0.809 . . . . 0.0 109.933 178.291 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.0 OUTLIER -66.77 -37.43 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 114.277 -1.329 . . . . 0.0 112.192 -178.916 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.563 ' HA ' ' CG ' ' A' ' 37' ' ' TYR . . . -61.26 -47.54 85.55 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 122.031 0.92 . . . . 0.0 109.662 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.048 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -68.98 -42.8 76.07 Favored 'General case' 0 N--CA 1.401 -2.881 0 CA-C-N 113.34 -1.755 . . . . 0.0 111.121 -177.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . 1.048 ' N ' HD13 ' B' ' 34' ' ' LEU . 4.6 mt-30 -64.3 -19.32 65.34 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -94.29 27.29 2.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.179 0.514 . . . . 0.0 109.647 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.688 ' CD1' ' CE1' ' A' ' 36' ' ' HIS . 7.9 t80 -103.16 156.02 18.0 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.494 -178.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.419 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.06 0 C-N-CA 124.449 1.1 . . . . 0.0 112.334 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.618 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 3.6 ttt85 . . . . . 0 N--CA 1.486 1.353 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -78.26 124.79 28.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.436 HD22 HD22 ' B' ' 12' ' ' LEU . 2.0 tp -138.61 141.03 39.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.308 -178.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.655 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -106.3 136.53 45.86 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 178.286 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.889 HD12 HG21 ' B' ' 30' ' ' ILE . 4.9 pt -146.95 175.5 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.597 ' C ' HD22 ' A' ' 7' ' ' LEU . 75.0 t-105 -98.78 109.17 21.97 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -177.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.869 HD11 ' CG2' ' B' ' 30' ' ' ILE . 0.9 OUTLIER -131.26 117.18 18.63 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.556 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 14.9 p -82.86 178.02 8.37 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 121.783 0.802 . . . . 0.0 111.969 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -53.88 -50.43 66.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.962 -1.472 . . . . 0.0 111.788 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.3 -35.9 3.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.229 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.847 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -101.01 -15.97 17.29 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 8' ' ' SER . 78.8 mt -69.58 -38.96 77.57 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 105.474 -2.047 . . . . 0.0 105.474 175.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -61.16 -41.09 96.14 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 113.226 -1.806 . . . . 0.0 107.502 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.847 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -53.58 -48.42 69.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.028 178.075 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.044 HD21 HD13 ' B' ' 34' ' ' LEU . 19.2 mt -80.41 16.07 1.43 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.478 -0.783 . . . . 0.0 113.099 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.563 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -100.41 -44.69 5.82 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.632 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.563 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 7.2 mttm -88.75 -38.74 14.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.703 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.549 ' CE ' HD23 ' A' ' 15' ' ' LEU . 46.8 mtm -66.28 -70.6 0.23 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.497 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.484 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -27.7 -32.1 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 125.081 1.352 . . . . 0.0 114.161 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.469 ' N ' ' O ' ' A' ' 18' ' ' MET . 1.5 mtt-85 . . . . . 0 C--N 1.309 -1.173 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.08 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.603 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 122.15 0.976 . . . . 0.0 113.0 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.463 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 14.8 p -66.22 158.92 27.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.635 -1.166 . . . . 0.0 109.852 178.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.52 -38.73 4.35 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.9 m -79.51 -52.65 7.75 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 122.089 0.156 . . . . 0.0 111.072 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.603 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -57.26 -27.39 62.05 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.26 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.986 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -64.53 -47.83 77.38 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 122.973 1.368 . . . . 0.0 108.824 177.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.6 HG22 HD11 ' B' ' 7' ' ' LEU . 0.4 OUTLIER -75.57 -27.83 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.499 0 CA-C-N 112.671 -2.059 . . . . 0.0 114.268 -176.389 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.482 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -73.36 -52.01 15.35 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.812 0.815 . . . . 0.0 109.277 177.039 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -55.22 -40.18 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-N 113.75 -1.568 . . . . 0.0 111.077 -179.516 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.691 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.34 -40.42 49.11 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.61 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.862 HD22 ' SD ' ' B' ' 29' ' ' MET . 12.1 mt -74.92 -35.49 62.19 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.256 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -74.41 -11.1 60.15 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.5 m80 -106.61 -46.86 3.89 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 117.089 -0.05 . . . . 0.0 110.967 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.696 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 12.0 t80 -41.65 147.68 0.18 Allowed 'General case' 0 CA--C 1.541 0.607 0 O-C-N 123.275 0.359 . . . . 0.0 111.836 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.523 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 6.0 tppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.171 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -95.33 105.81 17.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -121.45 142.87 49.61 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.957 -178.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.655 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -108.29 137.47 46.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 177.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.861 HD13 HD13 ' B' ' 7' ' ' LEU . 2.4 pp -151.59 167.88 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 121.179 0.514 . . . . 0.0 112.374 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -83.63 94.48 8.11 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.925 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.861 HD13 HD13 ' B' ' 5' ' ' ILE . 0.9 OUTLIER -129.29 99.89 5.39 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.216 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.618 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 52.3 p -72.66 -135.86 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.353 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.19 -151.7 0.27 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.891 -0.141 . . . . 0.0 111.295 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . 0.412 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.9 tt0 33.92 43.62 0.07 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.502 0.721 . . . . 0.0 112.634 179.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.689 ' CA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -173.24 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.705 179.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.734 HD21 ' HB3' ' B' ' 7' ' ' LEU . 22.8 mt -76.55 -42.0 44.57 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.44 -41.21 40.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.483 -1.689 . . . . 0.0 108.293 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.689 ' HB2' ' CA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.28 -17.37 1.74 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.424 179.008 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.051 HD13 ' HB2' ' B' ' 18' ' ' MET . 0.2 OUTLIER -71.59 21.04 0.05 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -179.683 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.17 -56.8 12.2 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 122.251 -0.281 . . . . 0.0 111.155 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 4.6 mtpm? -91.83 -2.05 57.06 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 1.051 ' HB2' HD13 ' B' ' 15' ' ' LEU . 3.9 mtm -96.99 -32.79 11.83 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.91 ' HB2' HD12 ' B' ' 15' ' ' LEU . . . -99.33 -73.3 0.63 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.475 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 0.2 OUTLIER -55.97 -62.41 1.72 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.556 0.694 . . . . 0.0 111.47 -179.371 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . 0.667 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.01 -28.0 3.63 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.708 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.943 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -87.97 -30.72 19.82 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.014 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.97 -7.48 31.22 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.886 -0.673 . . . . 0.0 114.519 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.943 HD13 ' CG ' ' B' ' 22' ' ' GLU . 0.0 OUTLIER -93.9 -174.02 3.31 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.096 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 96.4 p -103.97 164.2 11.86 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.099 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.1 OUTLIER -45.58 -40.47 8.84 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.279 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.596 ' HB2' ' HB3' ' A' ' 6' ' ' TRP . 59.8 p -81.43 -50.5 9.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.421 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.7 mm-40 -59.29 -20.1 51.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.72 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.985 ' SD ' HD21 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -72.22 -39.85 68.23 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 122.629 1.204 . . . . 0.0 108.63 177.469 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.889 HG21 HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -77.88 -38.09 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.482 0 CA-C-N 112.636 -2.074 . . . . 0.0 113.262 -175.494 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.427 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -60.8 -44.56 96.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 122.671 1.224 . . . . 0.0 107.815 175.755 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.427 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -59.97 -44.94 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 CA-C-N 112.271 -2.24 . . . . 0.0 111.872 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.696 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -51.8 -33.63 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.294 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.044 HD13 HD21 ' A' ' 15' ' ' LEU . 15.6 mt -76.4 -32.96 58.84 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.442 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -79.41 -16.72 55.71 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -123.73 21.18 9.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.17 0.441 . . . . 0.0 111.324 176.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.57 131.57 37.91 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.452 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.722 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.816 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.167 0.508 . . . . 0.0 112.104 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -92.02 120.58 32.79 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.56 ' HB3' HD23 ' B' ' 7' ' ' LEU . 2.8 tp -117.45 142.26 47.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.919 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -130.53 125.61 34.72 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.93 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.763 HD11 HG21 ' B' ' 30' ' ' ILE . 2.1 pt -152.02 -178.92 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.476 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.5 t-105 -94.72 98.38 10.74 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -177.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.903 HD11 HG22 ' B' ' 30' ' ' ILE . 1.5 mm? -125.09 111.34 15.23 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.5 t -76.8 -125.07 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 8.9 t70 -95.9 -45.47 6.93 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -68.43 45.41 0.04 OUTLIER 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.187 0.595 . . . . 0.0 112.005 -178.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.836 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.5 t -170.62 -42.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 31.4 mt -72.66 -39.82 66.81 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.582 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 0.2 OUTLIER -68.7 -39.58 80.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 113.511 -1.677 . . . . 0.0 107.033 176.01 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.836 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -48.3 -37.93 17.64 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.097 -1.411 . . . . 0.0 109.203 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.036 HD21 HD13 ' B' ' 34' ' ' LEU . 42.4 mt -84.86 33.39 0.53 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.811 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -107.55 -58.03 2.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.03 -33.47 61.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.734 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.644 ' CE ' HD23 ' A' ' 15' ' ' LEU . 33.4 mtm -74.84 -67.42 0.64 Allowed 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.019 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.5 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -28.87 -31.57 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.857 1.263 . . . . 0.0 114.121 -178.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' A' ' 18' ' ' MET . 3.7 mtt-85 . . . . . 0 C--N 1.31 -1.151 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.086 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.528 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.163 0 CA-C-O 122.226 1.013 . . . . 0.0 113.38 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -59.89 166.73 2.52 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.97 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -57.63 -42.68 83.87 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.98 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 94.2 p -74.24 -46.11 43.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.711 0.291 . . . . 0.0 110.273 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.528 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.5 mt-10 -61.08 -35.23 76.43 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.777 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.96 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -62.4 -47.95 81.88 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 123.64 1.686 . . . . 0.0 108.687 177.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.039 HG21 HD13 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -67.86 -15.68 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.979 0 CA-C-N 112.876 -1.965 . . . . 0.0 112.876 -177.572 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -83.3 -46.49 12.56 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.002 176.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.817 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -60.59 -34.86 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.978 0 CA-C-O 121.596 0.712 . . . . 0.0 109.217 177.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.961 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.28 -46.76 0.55 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.814 -1.539 . . . . 0.0 111.057 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.031 HD13 HD21 ' B' ' 15' ' ' LEU . 6.3 mt -87.26 -29.72 21.45 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.184 -178.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -83.64 -15.65 48.14 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.961 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -114.64 -4.46 12.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 -179.499 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.698 ' CD2' ' HD3' ' A' ' 38' ' ' LYS . 4.4 t80 -69.03 157.42 36.83 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.698 ' HD3' ' CD2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.181 0 C-N-CA 124.752 1.221 . . . . 0.0 112.899 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.375 0.131 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -81.43 121.52 26.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.68 140.55 50.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.469 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.919 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.84 129.86 56.34 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.062 HD12 HD21 ' B' ' 7' ' ' LEU . 1.4 pp -156.6 174.41 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.515 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.8 t-105 -91.76 116.11 28.62 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 1.062 HD21 HD12 ' B' ' 5' ' ' ILE . 0.6 OUTLIER -129.03 127.91 42.56 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 177.184 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.922 ' C ' HD23 ' B' ' 12' ' ' LEU . 7.9 p -82.13 -178.33 6.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 121.831 0.825 . . . . 0.0 111.1 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . 0.448 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 11.2 t70 -58.36 -44.99 89.06 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.309 -1.314 . . . . 0.0 113.172 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -75.68 40.53 0.19 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.089 0.471 . . . . 0.0 111.939 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.725 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 10.7 t -173.6 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.671 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.922 HD23 ' C ' ' B' ' 8' ' ' SER . 0.4 OUTLIER -61.18 -30.12 70.21 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.048 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.554 ' HG2' ' HG ' ' B' ' 12' ' ' LEU . 2.5 mm-40 -99.52 -36.07 9.67 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.974 -1.466 . . . . 0.0 109.584 177.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.725 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -42.91 -33.41 0.78 Allowed 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.881 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.031 HD21 HD13 ' A' ' 34' ' ' LEU . 49.1 mt -66.74 12.38 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -75.22 -52.47 10.83 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -93.76 -10.15 35.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.692 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.621 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 11.6 mtp -87.11 -21.28 26.11 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.682 0.277 . . . . 0.0 110.966 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.35 -67.93 0.82 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.826 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.8 mmm180 -58.93 -70.28 0.16 Allowed 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.57 -33.6 6.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.796 -179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.621 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 3.8 mm-40 -82.2 -25.41 34.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.291 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 98.6 64.38 0.86 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.439 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.81 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 179.21 178.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.209 0.528 . . . . 0.0 111.634 177.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . 0.551 ' N ' HD23 ' B' ' 24' ' ' LEU . 0.8 OUTLIER -105.2 169.08 8.65 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.71 -178.521 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.89 -41.3 11.17 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.7 p -78.09 -50.65 11.62 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.445 0.164 . . . . 0.0 110.986 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.568 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.1 mm-40 -65.52 -10.6 36.23 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.412 178.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.877 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.9 tpt -84.34 -48.45 9.69 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 122.689 1.233 . . . . 0.0 107.788 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.903 HG22 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -74.13 -34.91 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.95 0 CA-C-N 113.017 -1.901 . . . . 0.0 112.952 -177.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.436 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -65.91 -48.24 72.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 122.384 1.088 . . . . 0.0 109.032 177.386 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.449 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -58.73 -43.79 88.6 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.174 0 CA-C-N 112.865 -1.97 . . . . 0.0 111.671 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.869 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.32 -31.34 3.81 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.005 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.036 HD13 HD21 ' A' ' 15' ' ' LEU . 14.2 mt -91.86 -31.76 15.58 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -72.07 -15.03 62.01 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -111.23 19.81 17.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.114 0.415 . . . . 0.0 111.397 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.495 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 58.6 t80 -114.75 165.61 12.63 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.962 0.41 . . . . 0.0 111.823 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.484 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.162 0 C-N-CA 123.869 0.868 . . . . 0.0 112.603 178.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.582 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.696 0.284 . . . . 0.0 111.695 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.41 126.6 31.06 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -125.35 137.7 54.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.684 -178.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.955 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -115.98 121.51 42.49 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.231 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.902 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -145.86 176.3 1.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -177.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.628 ' O ' HD13 ' A' ' 7' ' ' LEU . 68.6 t-105 -94.02 100.83 12.89 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -177.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.856 HD21 HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -128.78 111.47 13.15 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 177.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.572 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 10.0 p -82.37 -176.79 6.39 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 121.724 0.774 . . . . 0.0 112.487 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -50.56 -47.78 57.72 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.474 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -47.03 -31.2 3.11 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.909 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -109.97 -15.29 14.09 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.5 mt -73.83 -41.04 62.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 105.901 -1.888 . . . . 0.0 105.901 176.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.41 -39.12 93.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.333 -1.758 . . . . 0.0 107.996 175.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.909 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -52.08 -44.68 64.47 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.558 178.78 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.041 ' CD2' HD13 ' B' ' 34' ' ' LEU . 19.6 mt -76.82 13.7 0.98 Allowed 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.3 mm-40 -98.9 -51.61 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 19.1 mttp -73.73 -26.1 60.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.211 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.67 ' CE ' HD23 ' A' ' 15' ' ' LEU . 58.8 mtm -81.71 -74.75 0.32 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.933 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.68 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.94 -43.42 3.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 122.908 0.483 . . . . 0.0 112.1 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.1 mmm180 . . . . . 0 CA--C 1.514 -0.414 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.68 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 94.9 mt . . . . . 0 N--CA 1.451 -0.423 0 CA-C-O 121.523 0.678 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.6 p -108.71 164.61 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.973 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.519 ' HB3' HG21 ' B' ' 5' ' ' ILE . 2.4 mttm -46.24 -31.97 2.78 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.418 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.1 m -84.29 -59.23 2.45 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 122.178 0.191 . . . . 0.0 111.139 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.582 ' HB3' HD22 ' A' ' 24' ' ' LEU . 2.8 mm-40 -59.72 -12.64 7.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.159 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 1.037 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.0 tpt -82.29 -47.17 12.71 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.855 1.312 . . . . 0.0 107.746 177.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.918 HD11 HD11 ' B' ' 34' ' ' LEU . 0.6 OUTLIER -75.55 -32.01 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 CA-C-N 112.847 -1.978 . . . . 0.0 113.782 -177.818 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.542 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -69.45 -48.81 59.66 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.185 0.993 . . . . 0.0 109.345 178.011 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.424 ' N ' HD22 ' A' ' 31' ' ' ASN . 1.6 t -59.22 -42.93 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.145 -1.843 . . . . 0.0 110.911 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.802 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -44.73 -41.62 6.98 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.331 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.854 HD23 ' CB ' ' B' ' 33' ' ' ALA . 8.2 mt -74.87 -33.98 62.16 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.836 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -70.95 -14.7 62.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.44 30.34 2.64 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.711 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -77.57 133.52 38.46 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 178.664 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.563 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 120.724 0.297 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -91.61 116.38 28.83 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.482 ' HB3' HD23 ' A' ' 7' ' ' LEU . 4.9 tp -116.46 139.43 50.46 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.736 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.955 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -122.95 123.47 40.99 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.239 178.662 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.803 HD12 HD21 ' B' ' 7' ' ' LEU . 1.3 pt -149.33 179.92 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.616 ' O ' HD13 ' B' ' 7' ' ' LEU . 71.1 t-105 -93.15 89.47 6.47 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.803 HD21 HD12 ' B' ' 5' ' ' ILE . 1.3 mm? -128.57 100.22 5.67 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.582 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 53.2 p -57.11 170.94 0.41 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 122.119 0.962 . . . . 0.0 112.779 -177.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.55 -40.0 94.79 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.319 -178.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . 0.492 ' O ' ' HB2' ' B' ' 14' ' ' ASP . 3.5 mm-40 -66.53 9.56 0.17 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.679 ' HA ' ' HB3' ' B' ' 14' ' ' ASP . 3.0 t -145.72 19.17 1.48 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' B' ' 8' ' ' SER . 13.0 mt -107.79 -46.4 3.8 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 175.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -88.02 -26.6 22.51 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 114.492 -1.231 . . . . 0.0 108.946 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.679 ' HB3' ' HA ' ' B' ' 11' ' ' THR . 6.5 t70 -55.77 -6.43 0.21 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 113.654 -1.612 . . . . 0.0 113.165 -179.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.955 HD23 ' SD ' ' B' ' 29' ' ' MET . 0.0 OUTLIER -135.86 35.06 2.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 121.357 0.599 . . . . 0.0 111.407 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.462 ' HB2' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -51.22 -31.5 20.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.721 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 9.3 mtpp -62.14 -24.7 67.32 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.078 0.466 . . . . 0.0 110.794 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.78 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 8.6 mtm -86.64 -25.05 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.052 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.611 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -100.3 -73.52 0.63 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.719 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.462 ' HD2' ' HB2' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -56.95 -65.05 0.68 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.163 0.506 . . . . 0.0 112.092 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 13.0 mmp_? -50.54 -27.53 6.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.38 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.862 ' HG2' HD12 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -91.65 -23.69 19.76 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.004 179.524 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.82 -5.55 34.76 Favored Glycine 0 C--N 1.34 0.75 0 C-N-CA 121.342 -0.456 . . . . 0.0 112.405 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.862 HD12 ' HG2' ' B' ' 22' ' ' GLU . 53.5 mt -80.59 178.52 8.29 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.664 0.745 . . . . 0.0 112.017 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' B' ' 29' ' ' MET . 3.7 t -120.15 179.9 4.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.723 178.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.82 -38.56 61.47 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.3 m -86.36 -51.31 6.31 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 121.91 0.084 . . . . 0.0 111.087 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.621 ' HB3' HD22 ' B' ' 24' ' ' LEU . 1.6 mm-40 -62.88 -9.3 9.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.413 178.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.955 ' SD ' HD23 ' B' ' 15' ' ' LEU . 4.9 tpt -79.93 -47.79 14.46 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 123.095 1.426 . . . . 0.0 107.685 177.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.902 HG21 HD11 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -79.37 -28.77 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 CA-C-N 112.213 -2.267 . . . . 0.0 114.191 -176.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.43 HD22 ' N ' ' B' ' 32' ' ' VAL . 0.2 OUTLIER -70.06 -49.38 51.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.214 1.007 . . . . 0.0 109.087 177.653 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.43 ' N ' HD22 ' B' ' 31' ' ' ASN . 2.0 t -56.94 -47.12 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.1 -1.864 . . . . 0.0 110.266 -179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.854 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -48.84 -37.1 18.47 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.225 178.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.041 HD13 ' CD2' ' A' ' 15' ' ' LEU . 12.9 mt -72.46 -34.87 68.04 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.058 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -79.09 -14.63 59.02 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -130.75 19.87 5.09 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.692 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -73.03 137.02 45.11 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 178.863 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.708 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 1.4 mmpt? . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.718 178.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.432 ' HG2' HD21 ' A' ' 3' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.29 121.53 24.54 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.3 mm? -126.43 141.65 51.81 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.3 OUTLIER -125.55 117.81 24.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.463 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.95 HD11 HG21 ' B' ' 30' ' ' ILE . 4.4 pt -147.33 175.56 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -92.99 98.77 11.57 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 -177.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.927 HD21 HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -119.28 115.38 24.05 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.623 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.0 p -71.58 -134.94 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.425 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.4 t70 -101.21 -41.09 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -73.11 38.97 0.09 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.123 0.487 . . . . 0.0 111.914 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.823 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.7 t -160.59 -43.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.676 HD21 ' HB2' ' A' ' 7' ' ' LEU . 53.8 mt -68.97 -41.04 78.47 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 175.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.65 -39.74 91.7 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 113.425 -1.716 . . . . 0.0 108.065 176.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.823 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t0 -48.0 -36.6 13.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 114.552 -1.203 . . . . 0.0 109.352 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.091 HD21 HD13 ' B' ' 34' ' ' LEU . 43.0 mt -79.85 27.2 0.3 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.099 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -100.86 -59.08 1.76 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -79.61 -5.93 56.04 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.573 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.774 ' CE ' HD23 ' A' ' 15' ' ' LEU . 43.6 mtm -100.99 -66.05 0.93 Allowed 'General case' 0 C--N 1.341 0.228 0 CA-C-N 116.993 -0.094 . . . . 0.0 110.837 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -29.23 -32.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.388 1.075 . . . . 0.0 113.613 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 18' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.311 -1.081 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.733 177.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 122.105 0.955 . . . . 0.0 112.996 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.467 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 1.7 p -61.4 161.09 9.8 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.509 -1.223 . . . . 0.0 109.714 178.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.87 -41.59 33.74 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.78 ' HA ' HD12 ' B' ' 5' ' ' ILE . 91.7 p -76.47 -51.72 11.22 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.574 ' O ' HG22 ' A' ' 32' ' ' VAL . 6.3 mt-10 -54.89 -31.22 59.72 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.956 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.5 tpt -64.47 -49.93 69.48 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 123.416 1.579 . . . . 0.0 108.877 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.018 HG21 HD11 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -66.37 -19.39 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.801 0 CA-C-N 113.325 -1.761 . . . . 0.0 112.813 -177.703 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.457 ' OD1' HG21 ' B' ' 11' ' ' THR . 0.0 OUTLIER -79.27 -51.57 9.28 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.634 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.793 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -53.41 -36.17 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.972 0 CA-C-O 121.499 0.666 . . . . 0.0 109.906 178.371 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.839 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.85 -47.68 0.7 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.034 -1.439 . . . . 0.0 111.18 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.045 HD13 ' CD2' ' B' ' 15' ' ' LEU . 5.6 mt -83.92 -25.41 30.18 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.049 -178.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -87.92 -9.21 54.33 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.241 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.839 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -136.24 22.22 3.22 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.78 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -88.29 140.45 29.46 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.04 0.536 . . . . 0.0 110.702 179.195 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.569 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.458 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.591 0.234 . . . . 0.0 111.61 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -85.41 123.3 30.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.451 ' HA ' HD13 ' B' ' 3' ' ' LEU . 2.7 mm? -129.12 148.56 51.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.913 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -133.77 121.43 21.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.781 179.176 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.018 HD11 HG21 ' A' ' 30' ' ' ILE . 5.0 pt -148.89 179.71 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.545 ' O ' HD13 ' B' ' 7' ' ' LEU . 75.2 t-105 -97.12 101.99 13.67 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -177.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.855 HD21 HG13 ' B' ' 5' ' ' ILE . 0.7 OUTLIER -126.86 117.01 21.74 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 18.4 p -73.18 -149.15 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.015 0.436 . . . . 0.0 111.343 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . 0.459 ' O ' HG22 ' B' ' 11' ' ' THR . 16.7 m-20 -96.22 -150.2 0.32 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.238 -178.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . 0.412 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 0.9 OUTLIER 35.55 43.15 0.15 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.251 0.62 . . . . 0.0 112.437 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.747 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 4.1 t -172.43 -46.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.403 ' HA ' HD12 ' A' ' 34' ' ' LEU . 19.0 mt -74.19 -39.2 63.33 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -89.63 -36.13 15.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 113.281 -1.781 . . . . 0.0 109.871 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.747 ' HB2' ' N ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -47.67 -25.45 1.2 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.32 -179.089 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.045 ' CD2' HD13 ' A' ' 34' ' ' LEU . 4.2 pp -83.81 34.18 0.49 Allowed 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 30.3 mm-40 -53.76 -28.21 33.33 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 3.3 mmtp -97.53 -5.94 34.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.714 ' HB2' ' HB2' ' B' ' 15' ' ' LEU . 14.2 mtm -89.84 -80.43 0.31 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.838 0.29 . . . . 0.0 110.562 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.69 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -49.03 -44.42 41.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.783 0.433 . . . . 0.0 111.846 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.475 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 2.2 mmm180 -62.74 -68.81 0.3 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 111.807 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -52.17 -32.6 36.72 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.981 179.488 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.535 ' HB3' ' HG ' ' B' ' 24' ' ' LEU . 21.4 mm-40 -84.9 -11.31 55.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.061 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.64 10.13 75.52 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.281 -177.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.69 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 92.4 mt -83.22 165.08 19.73 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.583 0.706 . . . . 0.0 111.58 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 72.6 p -107.26 164.71 11.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.141 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.13 -37.48 1.44 Allowed 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 3.4 t -82.42 -56.9 3.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.597 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.7 mm-40 -60.19 -14.22 16.35 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.887 0.375 . . . . 0.0 110.761 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.749 ' SD ' HD22 ' B' ' 15' ' ' LEU . 3.1 tpt -79.23 -46.39 17.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.831 1.3 . . . . 0.0 108.24 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.95 HG21 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -78.06 -31.34 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.104 0 CA-C-N 112.656 -2.066 . . . . 0.0 113.594 -177.26 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.422 HD22 ' N ' ' B' ' 32' ' ' VAL . 0.2 OUTLIER -68.67 -48.38 64.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.24 1.019 . . . . 0.0 109.331 177.768 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.422 ' N ' HD22 ' B' ' 31' ' ' ASN . 1.4 t -59.75 -43.0 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 CA-C-N 113.071 -1.877 . . . . 0.0 111.154 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.831 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -46.28 -34.43 4.46 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.114 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.091 HD13 HD21 ' A' ' 15' ' ' LEU . 13.5 mt -88.94 -28.48 20.24 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -74.8 -11.01 60.05 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -123.27 27.06 7.69 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.593 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 33.7 t80 -115.99 155.21 28.47 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 111.723 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.431 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.227 178.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.625 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.6 mpt_? . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.951 0.405 . . . . 0.0 111.735 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -107.71 109.23 20.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.56 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.441 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 2.2 tp -127.99 147.21 50.49 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.206 -178.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.755 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -108.84 138.21 45.54 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.544 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.844 ' CD1' HG21 ' B' ' 30' ' ' ILE . 2.1 pt -148.5 -179.9 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.546 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.0 t-105 -97.13 93.72 6.72 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -177.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.849 HD11 HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -125.78 103.67 7.93 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.566 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.1 p -74.38 -176.11 2.56 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.781 0.8 . . . . 0.0 112.439 -178.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.5 -49.03 65.58 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.689 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -46.05 -34.23 3.96 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.935 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -100.45 -22.38 15.05 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 8' ' ' SER . 59.9 mt -71.55 -39.89 70.36 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 176.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.89 -40.61 96.9 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 113.427 -1.715 . . . . 0.0 107.53 175.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.935 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -51.17 -43.29 61.27 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.513 -1.221 . . . . 0.0 108.923 178.138 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.063 HD21 HD13 ' B' ' 34' ' ' LEU . 25.0 mt -86.42 26.43 1.07 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -106.25 -53.42 2.63 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -76.3 -39.62 53.7 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.369 178.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.504 ' HE3' ' SD ' ' A' ' 29' ' ' MET . 35.4 mtm -68.24 -71.77 0.2 Allowed 'General case' 0 C--N 1.341 0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.655 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.496 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -28.08 -32.09 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.165 1.386 . . . . 0.0 114.302 -178.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.8 mmm180 . . . . . 0 C--N 1.309 -1.193 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.398 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.268 0 CA-C-O 122.157 0.98 . . . . 0.0 113.052 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.468 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 12.9 p -64.02 159.54 19.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.787 178.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.55 -38.84 6.81 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.763 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 22.3 m -81.51 -51.17 8.56 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 111.325 0.121 . . . . 0.0 111.325 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.539 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 4.4 mt-10 -56.56 -27.17 57.16 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 1.019 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.8 tpt -63.26 -47.69 81.33 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 122.951 1.357 . . . . 0.0 108.996 177.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.012 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -76.95 -36.74 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.599 0 CA-C-N 112.678 -2.055 . . . . 0.0 114.29 -176.456 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.425 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -63.5 -47.06 83.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.015 0.912 . . . . 0.0 108.927 178.04 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.65 -42.78 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.503 0 CA-C-N 113.431 -1.713 . . . . 0.0 110.795 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.76 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -52.59 -38.92 61.0 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.965 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.113 HD13 HD21 ' B' ' 15' ' ' LEU . 13.9 mt -73.98 -29.86 62.19 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.59 -178.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -18.6 54.82 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.965 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -107.0 -36.67 6.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.615 ' CE2' ' HB3' ' B' ' 18' ' ' MET . 2.7 t80 -29.06 134.05 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.259 0.623 . . . . 0.0 111.891 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.853 -1.07 . . . . 0.0 112.892 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -82.4 108.99 16.25 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.0 tp -130.26 145.38 51.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.182 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.755 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.0 OUTLIER -103.6 139.61 38.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.552 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.012 HD12 HG21 ' A' ' 30' ' ' ILE . 3.5 pt -148.17 179.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.763 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.8 t-105 -98.66 100.36 11.58 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -177.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.773 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -133.22 114.04 13.36 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 177.378 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.625 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -94.85 -166.35 1.45 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.524 0.678 . . . . 0.0 112.347 -178.244 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -44.93 -63.61 0.88 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.729 -1.123 . . . . 0.0 112.871 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -53.15 -27.23 20.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.664 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 70.0 p -91.08 -34.52 15.05 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' B' ' 8' ' ' SER . 56.2 mt -67.61 -37.96 83.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -43.35 88.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 113.561 -1.654 . . . . 0.0 107.526 176.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.664 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -52.58 -44.02 65.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.406 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.113 HD21 HD13 ' A' ' 34' ' ' LEU . 16.5 mt -76.29 29.64 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -114.56 -57.5 2.26 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.42 -31.56 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.636 178.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.796 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 7.9 mtm -82.51 -16.15 49.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.866 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.75 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.73 -65.28 0.97 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.858 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mtp-105 -60.89 -65.91 0.62 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.127 0.489 . . . . 0.0 111.533 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.19 -29.87 6.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.863 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.82 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -85.47 -35.31 21.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.631 179.525 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . 0.455 ' N ' ' HG3' ' B' ' 22' ' ' GLU . . . 106.56 67.81 0.67 Allowed Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.919 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.82 HD13 ' CG ' ' B' ' 22' ' ' GLU . 0.0 OUTLIER -178.26 -177.34 0.57 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.272 0.558 . . . . 0.0 112.059 178.299 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . 0.419 ' N ' HD23 ' B' ' 24' ' ' LEU . 19.1 p -110.81 170.75 7.89 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.121 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.432 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.8 mttm -40.88 -38.73 1.0 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -179.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 1.5 p -79.05 -56.66 4.21 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 117.838 0.29 . . . . 0.0 111.612 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.684 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.1 mt-10 -61.55 -15.63 40.35 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 1.045 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.7 tpt -77.15 -48.28 18.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 122.743 1.259 . . . . 0.0 108.279 178.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.88 HD11 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.88 -31.75 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.164 0 CA-C-N 112.885 -1.962 . . . . 0.0 113.462 -177.358 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -68.41 -47.92 66.01 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 122.271 1.034 . . . . 0.0 108.871 177.449 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.429 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.7 t -57.98 -44.69 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.038 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.723 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -49.09 -30.52 6.58 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.033 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.063 HD13 HD21 ' A' ' 15' ' ' LEU . 15.5 mt -80.93 -35.66 32.07 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.996 -177.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -77.86 -11.62 59.91 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -125.19 18.81 8.32 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.651 0.262 . . . . 0.0 111.215 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.42 132.59 38.57 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.767 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.695 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.605 178.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.695 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.493 ' C ' HD22 ' A' ' 3' ' ' LEU . 92.7 m95 -88.4 118.92 28.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.531 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.3 mm? -136.92 148.64 47.11 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.382 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.851 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -121.09 130.47 53.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 178.799 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.774 HD12 HD21 ' A' ' 7' ' ' LEU . 1.3 pt -147.79 -179.79 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.452 ' C ' HD22 ' A' ' 7' ' ' LEU . 69.3 t-105 -95.2 89.26 5.45 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.774 HD21 HD12 ' A' ' 5' ' ' ILE . 2.1 mm? -120.58 99.36 6.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 p -74.8 -141.04 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.208 -178.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.697 ' O ' HG22 ' A' ' 11' ' ' THR . 2.5 p-10 -79.58 -155.33 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.733 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.439 ' O ' ' HB ' ' A' ' 11' ' ' THR . 2.2 tt0 36.82 43.85 0.31 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.279 0.632 . . . . 0.0 112.412 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.697 HG22 ' O ' ' A' ' 9' ' ' ASP . 11.8 t -174.96 -48.2 0.01 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.096 -0.957 . . . . 0.0 112.152 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.627 HD11 ' O ' ' A' ' 7' ' ' LEU . 15.1 mt -78.23 -39.71 39.55 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 105.68 -1.97 . . . . 0.0 105.68 175.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -41.9 62.94 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 113.268 -1.787 . . . . 0.0 106.933 176.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.69 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.02 -27.3 7.53 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.017 -1.447 . . . . 0.0 109.569 178.231 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.248 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -76.64 31.34 0.13 Allowed 'General case' 0 N--CA 1.426 -1.643 0 C-N-CA 124.161 0.984 . . . . 0.0 113.044 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -74.65 -61.52 1.85 Allowed 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.288 -0.257 . . . . 0.0 111.535 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -98.11 7.2 46.65 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.825 ' HB2' HD13 ' A' ' 15' ' ' LEU . 23.2 mtm -88.18 -82.05 0.24 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.879 0.309 . . . . 0.0 111.617 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.656 ' H ' ' CD1' ' A' ' 15' ' ' LEU . . . -23.87 -35.78 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 126.444 1.898 . . . . 0.0 114.286 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 18' ' ' MET . 5.0 mtt-85 . . . . . 0 C--N 1.306 -1.283 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.087 179.226 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.492 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.1 mp . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 121.988 0.899 . . . . 0.0 112.671 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -70.53 150.3 46.26 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.149 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -38.79 -39.43 0.51 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.451 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 m -81.12 -54.96 5.08 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 122.028 0.131 . . . . 0.0 110.734 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -55.32 -29.88 59.15 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 1.248 ' SD ' HD11 ' A' ' 15' ' ' LEU . 4.1 tpt -59.45 -47.49 85.3 Favored 'General case' 0 N--CA 1.44 -0.975 0 CA-C-O 123.028 1.394 . . . . 0.0 109.714 177.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.635 HD13 HD21 ' B' ' 34' ' ' LEU . 0.3 OUTLIER -75.77 -21.39 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.686 0 CA-C-N 112.257 -2.247 . . . . 0.0 113.779 -175.812 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.444 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.3 OUTLIER -78.18 -51.57 10.02 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.983 0.897 . . . . 0.0 109.985 177.164 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.444 ' N ' HD22 ' A' ' 31' ' ' ASN . 1.6 t -63.53 -34.98 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-N 113.705 -1.589 . . . . 0.0 111.155 -179.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.8 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -46.9 -61.45 1.86 Allowed 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.339 -1.301 . . . . 0.0 112.438 -179.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.907 HD22 ' N ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -74.71 -28.09 60.66 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.048 -176.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.907 ' N ' HD22 ' A' ' 34' ' ' LEU . 9.2 mt-30 -56.55 -24.4 46.71 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.435 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -125.48 31.53 5.53 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.411 0.624 . . . . 0.0 109.505 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.807 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -87.85 139.38 30.58 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.171 179.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.555 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.123 -0.941 . . . . 0.0 111.187 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 2.2 ttt-85 . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -73.97 128.08 34.57 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -133.29 140.47 47.47 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.517 -178.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.851 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -121.55 130.25 53.41 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.619 HD13 HD13 ' B' ' 7' ' ' LEU . 2.3 pp -150.9 165.0 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -85.48 103.6 14.5 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.761 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.619 HD13 HD13 ' B' ' 5' ' ' ILE . 1.1 tp -124.69 113.87 18.57 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.904 ' O ' HD23 ' B' ' 12' ' ' LEU . 12.5 p -77.03 -173.44 2.74 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 121.449 0.642 . . . . 0.0 110.74 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -59.41 -155.77 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.562 -1.199 . . . . 0.0 112.528 -178.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . 0.517 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.7 tt0 37.45 39.84 0.19 Allowed 'General case' 0 C--N 1.344 0.349 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.696 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.2 t 177.61 -51.56 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.965 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.904 HD23 ' O ' ' B' ' 8' ' ' SER . 0.4 OUTLIER -70.64 -27.56 64.14 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.002 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.31 -43.41 6.96 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.415 -1.72 . . . . 0.0 107.66 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.696 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.7 m-20 -56.17 -16.4 5.18 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.201 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.83 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.1 OUTLIER -70.32 23.58 0.03 OUTLIER 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.84 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -87.61 -36.25 17.61 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 11.1 pttm -102.97 -1.92 28.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.819 ' SD ' HD22 ' B' ' 15' ' ' LEU . 53.3 mtp -91.45 -84.49 0.26 Allowed 'General case' 0 C--N 1.34 0.182 0 O-C-N 122.259 -0.276 . . . . 0.0 110.45 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.617 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -45.55 -45.28 13.41 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.343 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -69.18 0.24 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 120.966 0.412 . . . . 0.0 111.769 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -33.49 42.77 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -81.3 -12.18 59.13 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.916 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.29 85.58 Favored Glycine 0 C--N 1.34 0.786 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.569 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.8 HD22 ' HB3' ' B' ' 28' ' ' GLU . 96.5 mt -85.04 174.89 9.38 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.736 0.779 . . . . 0.0 111.392 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 19.4 p -116.58 172.71 7.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.747 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.455 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -48.96 -34.2 12.49 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.477 ' HA ' HD12 ' A' ' 5' ' ' ILE . 4.6 p -86.56 -54.52 4.35 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.8 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.0 mt-10 -60.02 -11.17 5.21 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.452 0.168 . . . . 0.0 111.038 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.83 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.4 tpt -84.36 -46.98 11.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.532 1.158 . . . . 0.0 107.995 177.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.636 HG22 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -76.38 -29.76 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.139 0 CA-C-N 113.038 -1.892 . . . . 0.0 113.132 -177.359 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.473 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -71.49 -50.92 26.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 122.206 1.003 . . . . 0.0 109.088 177.371 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.439 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 2.0 t -54.82 -41.58 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 CA-C-N 113.164 -1.835 . . . . 0.0 110.16 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.891 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . . . -43.36 -43.12 4.93 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.831 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.035 HD13 HD23 ' A' ' 15' ' ' LEU . 9.6 mt -79.27 -29.88 42.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.922 -177.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -78.56 -16.32 57.57 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -132.55 21.04 4.29 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.463 0.574 . . . . 0.0 112.293 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.543 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -74.79 139.03 43.01 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.178 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.47 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.853 -0.594 . . . . 0.0 112.474 178.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.742 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 121.146 0.498 . . . . 0.0 112.034 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -114.12 114.36 25.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.1 tp -129.14 138.42 51.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.429 -177.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.891 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -115.97 123.82 48.99 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.859 HG13 HD21 ' A' ' 7' ' ' LEU . 3.9 pt -145.85 178.84 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.521 0.564 . . . . 0.0 112.521 -177.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.559 ' O ' HD13 ' A' ' 7' ' ' LEU . 66.0 t-105 -90.91 98.33 11.71 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.859 HD21 HG13 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -130.24 107.78 9.54 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.686 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 23.0 t -72.45 -129.95 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -178.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.773 ' O ' HG22 ' A' ' 11' ' ' THR . 0.8 OUTLIER -97.74 -154.8 0.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -178.614 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.43 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.0 OUTLIER 34.95 45.96 0.18 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.28 0.632 . . . . 0.0 111.885 179.434 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.773 HG22 ' O ' ' A' ' 9' ' ' ASP . 13.9 t -174.78 -48.37 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.706 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.708 HD22 HD13 ' B' ' 3' ' ' LEU . 28.4 mt -73.82 -42.5 60.82 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 176.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.07 -38.58 79.11 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 113.368 -1.742 . . . . 0.0 107.442 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.683 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 2.2 t0 -48.72 -33.8 10.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.014 -1.448 . . . . 0.0 110.198 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.039 HD21 HD13 ' B' ' 34' ' ' LEU . 54.1 mt -69.2 16.67 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -76.23 -61.61 1.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.173 -0.329 . . . . 0.0 110.367 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -83.72 -17.57 40.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.927 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.745 ' CE ' HD23 ' A' ' 15' ' ' LEU . 10.8 mtm -83.01 -28.47 29.64 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.363 0.125 . . . . 0.0 111.294 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.874 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -98.04 -64.13 1.07 Allowed 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.512 -0.516 0 CA-C-O 120.83 0.347 . . . . 0.0 111.774 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.874 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 120.778 0.323 . . . . 0.0 111.737 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 t -116.43 174.17 6.21 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.18 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.477 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -43.58 -38.63 3.07 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -179.179 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.689 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 1.5 m -76.96 -60.36 2.39 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.567 0.347 . . . . 0.0 111.458 -179.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.0 mt-10 -58.84 -17.53 24.64 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.995 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.7 tpt -75.94 -47.7 24.11 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 122.757 1.265 . . . . 0.0 108.471 177.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.802 HD13 HD21 ' B' ' 34' ' ' LEU . 0.5 OUTLIER -74.0 -35.72 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 112.7 -2.046 . . . . 0.0 113.214 -177.213 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.421 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.92 -45.85 76.65 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 122.003 0.906 . . . . 0.0 108.882 176.932 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.503 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -58.91 -41.32 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.575 0 CA-C-N 113.387 -1.733 . . . . 0.0 110.282 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.627 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -52.69 -38.27 60.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.99 178.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.581 HD12 ' HB ' ' B' ' 11' ' ' THR . 17.8 mt -71.66 -30.41 65.68 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.074 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -79.79 -17.19 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.387 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.56 24.4 4.75 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.71 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -77.51 125.09 28.78 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.72 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.092 -0.956 . . . . 0.0 111.343 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.686 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -88.97 134.76 33.86 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.708 HD13 HD22 ' A' ' 12' ' ' LEU . 2.7 tp -129.34 142.51 50.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.606 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.891 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -125.85 127.5 46.16 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.368 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.462 ' C ' HD12 ' B' ' 5' ' ' ILE . 2.4 pp -154.37 169.56 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.689 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 66.5 t-105 -80.88 113.92 19.41 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.409 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 15.1 tp -144.96 102.26 3.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -178.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.742 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 14.0 p -79.29 178.08 8.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -176.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . 0.425 ' HB2' ' NH2' ' A' ' 1' ' ' ARG . 9.3 t70 -51.74 -50.63 60.23 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 113.093 -1.867 . . . . 0.0 112.497 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -47.74 -27.82 2.17 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.657 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 22.2 p -100.32 -22.78 14.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' B' ' 8' ' ' SER . 31.2 mt -79.21 -42.3 26.33 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 178.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.498 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.0 mt-10 -62.04 -41.72 98.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.033 -1.439 . . . . 0.0 107.507 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.657 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.75 -45.4 58.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.325 -1.307 . . . . 0.0 109.699 178.171 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.041 HD13 ' HG2' ' B' ' 18' ' ' MET . 1.2 mm? -82.53 22.2 0.89 Allowed 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.655 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.2 OUTLIER -80.34 -47.93 13.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.819 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.655 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 24.3 mtpp -102.92 -10.81 18.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.837 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 1.041 ' HG2' HD13 ' B' ' 15' ' ' LEU . 0.1 OUTLIER -105.86 4.64 29.92 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.027 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.852 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -99.76 -15.22 18.54 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.883 -0.51 . . . . 0.0 112.367 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 -77.89 -97.9 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.61 -27.63 62.92 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.922 0.391 . . . . 0.0 110.59 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' B' ' 18' ' ' MET . 24.4 mm-40 -101.95 -21.12 14.58 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . 1.028 ' C ' HD13 ' B' ' 24' ' ' LEU . . . -102.51 -20.59 11.73 Favored Glycine 0 N--CA 1.467 0.706 0 C-N-CA 119.907 -1.14 . . . . 0.0 113.09 -179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 1.028 HD13 ' C ' ' B' ' 23' ' ' GLY . 0.0 OUTLIER 44.84 27.96 0.31 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 179.146 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . 0.738 ' HB2' ' HB2' ' B' ' 28' ' ' GLU . 0.5 OUTLIER 132.1 142.06 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 127.659 2.384 . . . . 0.0 109.449 177.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -45.84 -50.8 13.85 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 117.676 0.216 . . . . 0.0 111.206 -178.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.546 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 73.4 p -81.43 -35.71 30.31 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.594 0.235 . . . . 0.0 110.869 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.881 ' HB3' ' CD2' ' B' ' 24' ' ' LEU . 13.4 mm-40 -61.72 -26.93 68.36 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.035 179.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 1.038 ' HE3' HD11 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -68.12 -38.18 81.96 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-O 122.534 1.159 . . . . 0.0 109.263 178.52 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.68 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -80.17 -30.66 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.5 0 CA-C-N 112.999 -1.909 . . . . 0.0 112.837 -175.363 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -44.8 86.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.81 HG21 HD11 ' B' ' 24' ' ' LEU . 2.1 t -58.41 -48.34 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.375 0 CA-C-N 112.422 -2.172 . . . . 0.0 111.854 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.599 ' HB1' ' HB1' ' A' ' 33' ' ' ALA . . . -47.14 -40.57 15.94 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.557 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.039 HD13 HD21 ' A' ' 15' ' ' LEU . 12.3 mt -75.73 -32.11 59.89 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.157 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 11.8 mt-30 -78.47 -15.15 58.94 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 25.9 m80 -122.28 6.15 9.67 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.514 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 0.5 OUTLIER -64.7 139.31 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.688 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 123.396 0.678 . . . . 0.0 112.368 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 1.2 ttt-85 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -73.18 123.36 23.49 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 178.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.818 HD22 HD22 ' B' ' 12' ' ' LEU . 2.2 tp -131.01 149.32 52.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.791 -178.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.941 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -118.33 132.32 56.28 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.995 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.848 ' CD1' HG21 ' B' ' 30' ' ' ILE . 3.6 pt -147.53 176.54 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.642 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.2 t-105 -96.57 103.59 15.51 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -177.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.715 HD11 ' CG2' ' B' ' 30' ' ' ILE . 0.7 OUTLIER -131.86 113.63 13.7 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.636 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.689 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 12.6 p -79.17 -176.85 5.35 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.727 0.775 . . . . 0.0 112.707 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -47.16 -60.42 2.49 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.369 -1.287 . . . . 0.0 112.552 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -50.61 -25.88 4.7 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.575 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 23.6 p -94.21 -34.08 13.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.7 mt -65.43 -41.13 93.84 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.42 -43.95 97.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 113.846 -1.524 . . . . 0.0 108.508 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.575 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -55.23 -50.05 70.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.491 179.081 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.003 HD21 HD13 ' B' ' 34' ' ' LEU . 14.2 mt -75.07 17.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 10.3 mm-40 -115.31 -56.35 2.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.1 mttp -76.23 -31.64 58.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.042 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.738 ' HE2' ' CD2' ' A' ' 15' ' ' LEU . 0.7 OUTLIER -97.88 21.12 11.01 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.184 0.516 . . . . 0.0 111.425 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.686 ' HA ' HD21 ' A' ' 24' ' ' LEU . . . -110.97 -64.72 1.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.472 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER . . . . . 0 CA--C 1.514 -0.416 0 CA-C-O 121.162 0.506 . . . . 0.0 111.542 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.716 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.416 0 CA-C-O 121.567 0.699 . . . . 0.0 112.316 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.513 ' N ' HD23 ' A' ' 24' ' ' LEU . 3.3 t -117.65 -179.42 3.73 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.559 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -45.06 -38.2 4.78 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.506 ' O ' HD11 ' B' ' 7' ' ' LEU . 12.0 m -78.01 -62.57 1.63 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.716 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 4.4 mt-10 -59.99 -14.49 16.35 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.902 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.1 tpt -78.44 -47.12 18.16 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 123.791 1.758 . . . . 0.0 107.115 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.047 HG22 HD11 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -64.84 -20.81 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.69 0 CA-C-N 113.065 -1.879 . . . . 0.0 112.19 -179.131 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.47 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -79.39 -52.52 7.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.152 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.862 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -52.05 -33.21 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.848 0 CA-C-O 121.462 0.649 . . . . 0.0 110.395 178.525 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.88 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.2 -43.01 0.33 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.822 -1.535 . . . . 0.0 111.059 178.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.663 HD13 ' CD2' ' B' ' 15' ' ' LEU . 7.1 mt -84.63 -35.2 22.83 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.425 -179.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -69.16 -25.6 64.44 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.88 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 6.9 p-80 -101.15 -29.58 12.04 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.712 0.687 . . . . 0.0 112.474 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.649 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 9.1 t80 -50.68 144.07 8.67 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 117.917 -1.04 . . . . 0.0 112.251 178.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.689 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 121.034 0.445 . . . . 0.0 111.809 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . 0.41 ' C ' HD22 ' B' ' 3' ' ' LEU . 85.7 m95 -110.06 116.29 31.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.137 177.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.522 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.2 mm? -131.9 150.66 52.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.258 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.941 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -117.17 132.78 56.57 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.579 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.709 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.3 pt -151.52 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.61 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.2 t-105 -94.89 97.02 9.7 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -177.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 1.047 HD11 HG22 ' A' ' 30' ' ' ILE . 2.2 mm? -130.38 108.09 9.73 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 27.5 t -67.96 -125.78 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -176.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' B' ' 11' ' ' THR . 14.4 t70 -101.1 -40.12 7.35 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -176.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -72.34 39.69 0.08 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.706 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 6.5 t -162.19 -41.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.818 HD22 HD22 ' A' ' 3' ' ' LEU . 20.2 mt -74.37 -42.67 58.92 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.23 -37.78 72.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.567 -1.651 . . . . 0.0 108.151 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.706 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.2 t70 -45.38 -33.68 2.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.083 HD22 ' CG ' ' B' ' 29' ' ' MET . 41.5 mt -82.47 27.51 0.5 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -97.71 -51.63 4.03 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -82.84 -17.29 44.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.506 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.488 ' HA ' ' HB2' ' B' ' 22' ' ' GLU . 14.3 mtm -92.23 -70.19 0.71 Allowed 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.314 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.82 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -28.68 -31.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.916 1.286 . . . . 0.0 114.358 -178.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.46 ' N ' ' O ' ' B' ' 18' ' ' MET . 9.0 mtp-105 -67.19 -121.71 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.918 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 tpp85 -52.46 -23.96 7.08 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.915 -0.491 . . . . 0.0 111.645 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.488 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 0.8 OUTLIER -108.08 -1.65 20.25 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -177.519 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . 0.82 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -151.01 20.43 0.97 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 115.623 -3.179 . . . . 0.0 117.912 -176.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.652 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.1 mp 50.26 -157.33 0.09 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 120.108 1.954 . . . . 0.0 113.254 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -64.57 162.65 15.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.681 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.44 -44.58 17.47 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.555 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 14.8 m -82.91 -47.91 11.28 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.165 0.061 . . . . 0.0 111.165 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.471 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 2.6 mt-10 -55.61 -28.31 54.51 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 1.083 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.9 tpt -63.61 -48.69 76.3 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.682 1.229 . . . . 0.0 109.537 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.848 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -77.54 -30.32 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.668 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.877 -176.289 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.455 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -68.51 -48.12 65.2 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.044 177.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.455 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.4 t -58.37 -43.85 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-N 113.314 -1.766 . . . . 0.0 110.675 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.87 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -51.34 -32.75 26.68 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.783 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.003 HD13 HD21 ' A' ' 15' ' ' LEU . 11.2 mt -83.82 -28.99 27.67 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.889 -178.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -74.51 -16.24 60.84 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.278 0.474 . . . . 0.0 112.278 -179.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.9 m80 -123.05 42.22 3.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.788 0.328 . . . . 0.0 111.104 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.72 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.6 OUTLIER -58.14 133.13 55.33 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.423 0.63 . . . . 0.0 112.108 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.637 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 4.2 tptt . . . . . 0 C--O 1.249 1.072 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.675 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.531 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.795 0 CA-C-O 120.688 0.28 . . . . 0.0 111.718 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -95.19 110.77 22.69 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.417 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 3.0 tp -123.39 145.54 48.69 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.513 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.963 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -117.32 134.99 54.17 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 1.039 ' CD1' HD21 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -157.15 177.68 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.57 ' O ' HD13 ' A' ' 7' ' ' LEU . 69.8 t-105 -91.34 101.04 13.73 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.039 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.4 OUTLIER -125.56 106.59 9.87 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.378 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.429 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.1 t -85.57 -137.0 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.921 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.82 -157.33 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.566 0.209 . . . . 0.0 111.566 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 35.05 43.96 0.12 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.34 0.656 . . . . 0.0 112.247 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.66 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.85 -51.21 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.598 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.453 ' N ' ' CG2' ' A' ' 11' ' ' THR . 16.5 mt -72.22 -40.58 67.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -74.98 -40.9 60.46 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.195 -1.82 . . . . 0.0 107.982 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.66 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -51.44 -27.61 10.77 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 114.625 -1.171 . . . . 0.0 109.948 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.953 HD22 ' HE3' ' A' ' 18' ' ' MET . 0.2 OUTLIER -80.8 36.19 0.38 Allowed 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 124.286 1.035 . . . . 0.0 112.927 -179.684 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -79.79 -59.15 2.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.271 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -101.98 23.42 11.51 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.953 ' HE3' HD22 ' A' ' 15' ' ' LEU . 6.5 mtm -103.85 -86.25 0.45 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.186 -0.321 . . . . 0.0 110.922 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.73 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -45.75 -44.75 14.04 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.088 0.555 . . . . 0.0 111.507 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HD2' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.361 0 CA-C-O 120.993 0.425 . . . . 0.0 111.664 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.73 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 99.2 mt . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.493 0.663 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -120.81 167.79 12.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.334 177.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.403 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 2.4 mttm -43.19 -38.61 2.57 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.722 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.1 m -84.3 -54.76 4.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.5 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.3 mm-40 -62.09 -9.87 8.61 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.191 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.871 ' SD ' HD11 ' A' ' 15' ' ' LEU . 2.5 tpt -87.22 -46.98 9.23 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.616 1.198 . . . . 0.0 108.123 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.9 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.7 OUTLIER -75.56 -34.37 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.127 0 CA-C-N 112.948 -1.933 . . . . 0.0 112.773 -177.83 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.443 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -65.75 -48.08 73.07 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.327 1.06 . . . . 0.0 108.905 177.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.443 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 1.2 t -60.38 -40.81 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 CA-C-N 112.932 -1.94 . . . . 0.0 111.098 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.913 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -46.33 -43.98 16.41 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.885 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.825 HD21 ' HB2' ' B' ' 33' ' ' ALA . 10.5 mt -80.11 -29.41 38.99 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.809 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -66.78 -19.06 65.67 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.33 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -120.7 43.53 2.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.121 0.486 . . . . 0.0 109.908 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.607 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 70.3 t80 -80.74 161.39 24.59 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.777 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.716 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 5.3 mmpt? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.244 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.42 0.153 . . . . 0.0 111.283 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . 0.516 ' C ' HD22 ' B' ' 3' ' ' LEU . 91.9 m95 -86.12 121.56 28.9 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.516 HD22 ' C ' ' B' ' 2' ' ' TRP . 2.4 mm? -138.44 153.55 48.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.301 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.963 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -113.27 129.85 56.41 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.223 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.9 ' CD1' HG21 ' A' ' 30' ' ' ILE . 3.9 pt -141.38 173.74 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.722 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 71.4 t-105 -99.43 97.71 8.71 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.854 HD21 HG13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -125.3 105.63 9.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.561 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 8.7 p -79.41 -164.36 0.63 Allowed 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 121.607 0.717 . . . . 0.0 112.207 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . 0.415 ' O ' ' HG3' ' B' ' 13' ' ' GLU . 15.9 m-20 -64.47 -44.23 91.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.285 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -64.06 5.68 0.23 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.723 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.2 p -125.2 -42.89 1.97 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' B' ' 8' ' ' SER . 25.5 mt -68.86 -40.81 79.1 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.1 mt-10 -66.33 -40.27 89.78 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.144 176.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.723 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.09 -36.7 30.49 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.836 178.574 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.169 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.35 31.19 0.34 Allowed 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.298 -179.492 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.474 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 4.5 pt-20 -79.52 -46.41 17.44 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.416 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 3.7 ptpp? -108.36 -4.8 17.1 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.663 ' HB2' HD13 ' B' ' 15' ' ' LEU . 22.1 mtp -83.89 -74.23 0.38 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.898 0.317 . . . . 0.0 111.812 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.977 ' HB2' HD12 ' B' ' 15' ' ' LEU . . . -26.61 -33.87 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.789 1.636 . . . . 0.0 114.015 -177.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' B' ' 18' ' ' MET . 8.7 mtp-105 -66.9 -114.13 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.193 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -58.92 -21.35 57.66 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.576 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 2.4 mt-10 -113.0 -5.86 13.77 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . 0.775 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -143.92 16.55 2.17 Favored Glycine 0 CA--C 1.502 -0.72 0 C-N-CA 116.442 -2.79 . . . . 0.0 116.719 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.631 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.2 mp 52.74 -162.51 0.09 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 119.271 1.536 . . . . 0.0 112.926 176.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.8 m -62.48 157.69 19.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.102 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -40.42 23.49 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 117.594 0.179 . . . . 0.0 111.149 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -77.55 -50.34 12.78 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.619 0.247 . . . . 0.0 110.558 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.482 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 0.8 OUTLIER -58.19 -30.91 66.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.278 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 1.169 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.3 tpt -63.4 -46.13 87.83 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 123.854 1.787 . . . . 0.0 108.752 177.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.952 HG22 HD11 ' A' ' 7' ' ' LEU . 0.4 OUTLIER -67.65 -15.96 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.151 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.998 -177.385 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -47.43 12.16 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 176.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.823 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -57.79 -32.88 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.212 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.656 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 1.046 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.17 -43.91 1.13 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 113.899 -1.5 . . . . 0.0 110.884 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.941 HD13 ' CD2' ' A' ' 15' ' ' LEU . 8.8 mt -80.64 -31.05 36.62 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.437 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' B' ' 32' ' ' VAL . 4.3 mt-30 -87.14 -12.8 45.94 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 1.046 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -118.34 6.39 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 179.526 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.74 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -78.28 141.83 38.24 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.901 0.48 . . . . 0.0 110.468 179.547 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.461 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.903 -1.046 . . . . 0.0 112.039 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.531 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -72.4 124.35 24.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.895 HD22 HD22 ' B' ' 12' ' ' LEU . 1.4 tp -131.27 149.41 52.58 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.745 -178.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -117.95 128.47 54.83 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.933 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.6 pt -145.35 173.91 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.48 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 75.1 t-105 -98.83 108.99 21.82 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.73 HD11 HD12 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -124.94 121.38 34.3 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.709 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.854 ' C ' HD23 ' A' ' 12' ' ' LEU . 15.6 p -80.84 178.73 8.2 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-O 121.704 0.764 . . . . 0.0 110.885 -179.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -59.63 -43.26 93.9 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.932 -178.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -78.25 40.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 111.642 -179.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.729 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 10.3 t -174.75 -51.73 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.961 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.913 HD22 ' HB2' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -58.52 -30.41 67.04 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.33 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -92.88 -37.1 12.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.042 -1.436 . . . . 0.0 109.216 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.729 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.3 t70 -45.41 -35.32 3.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.517 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.033 HD21 HD13 ' B' ' 34' ' ' LEU . 45.6 mt -58.12 -11.31 2.46 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.24 -61.51 1.98 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -63.65 -21.53 66.43 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.726 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.879 ' SD ' HD23 ' A' ' 15' ' ' LEU . 7.0 mtp -83.89 -76.42 0.29 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.01 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.704 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.89 -43.06 2.93 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.028 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 mtp85 . . . . . 0 CA--C 1.517 -0.316 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.179 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.704 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 97.8 mt . . . . . 0 N--CA 1.45 -0.464 0 CA-C-O 121.583 0.706 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -114.84 166.73 11.45 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.425 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.64 -39.09 3.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 p -84.09 -52.92 5.9 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.482 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.5 mm-40 -62.48 -11.29 15.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.45 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.849 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.3 tpt -87.69 -48.28 7.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.41 1.576 . . . . 0.0 107.324 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.937 HG22 HD11 ' B' ' 7' ' ' LEU . 0.6 OUTLIER -68.08 -24.09 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.555 0 CA-C-N 113.571 -1.65 . . . . 0.0 112.143 -179.071 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.464 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -76.17 -46.4 28.7 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 177.155 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.837 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -57.43 -36.09 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.975 0 CA-C-O 121.57 0.7 . . . . 0.0 109.658 178.397 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.912 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -37.04 -47.27 0.72 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.193 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.073 HD13 HD21 ' B' ' 15' ' ' LEU . 7.8 mt -83.36 -28.86 28.68 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.967 -178.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -86.64 -10.56 53.57 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.912 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -128.96 15.94 6.28 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.649 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -81.89 142.51 32.43 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.118 0.567 . . . . 0.0 109.54 178.505 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.463 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.164 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.881 178.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.913 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . 0.409 ' C ' HD22 ' B' ' 3' ' ' LEU . 95.6 m95 -87.83 116.73 26.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.53 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -132.34 155.82 47.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.549 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -122.23 130.66 53.39 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.569 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.764 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.4 pt -150.63 -178.27 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.476 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.7 t-105 -94.6 93.26 7.48 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -177.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.937 HD11 HG22 ' A' ' 30' ' ' ILE . 1.6 mm? -125.12 110.76 14.52 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 25.7 t -68.35 -126.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -103.63 -41.04 6.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -72.35 41.42 0.09 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.847 0.459 . . . . 0.0 111.95 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.701 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 6.6 t -163.44 -43.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.895 HD22 HD22 ' A' ' 3' ' ' LEU . 22.8 mt -72.65 -41.65 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.43 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.1 mt-10 -74.23 -36.04 63.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.346 -1.752 . . . . 0.0 108.541 176.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.701 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.3 t70 -46.72 -36.45 7.19 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.496 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.073 HD21 HD13 ' A' ' 34' ' ' LEU . 47.5 mt -71.51 -2.75 17.9 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.43 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.6 OUTLIER -72.3 -36.99 69.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -91.79 -9.68 42.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.426 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.701 ' HE2' ' HB3' ' A' ' 34' ' ' LEU . 6.6 mtm -100.42 -76.46 0.55 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.105 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.668 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -41.09 -44.36 2.45 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 122.595 0.358 . . . . 0.0 111.4 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.498 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.6 mmm180 -64.03 -68.57 0.34 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.028 0.442 . . . . 0.0 111.901 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -52.6 -29.68 27.21 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.252 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -90.55 -8.56 49.93 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.43 7.61 73.56 Favored Glycine 0 C--N 1.342 0.871 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.897 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.668 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.0 mt -85.67 172.88 10.53 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.525 0.679 . . . . 0.0 111.42 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -110.25 165.06 12.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.482 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.9 -41.97 12.07 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.48 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 74.6 m -84.84 -48.19 9.6 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.717 0.266 . . . . 0.0 111.717 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -64.81 -10.29 26.9 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.596 0.236 . . . . 0.0 111.223 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 1.072 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.8 tpt -85.89 -47.51 9.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.933 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -73.54 -35.15 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.065 0 CA-C-N 113.092 -1.867 . . . . 0.0 113.151 -178.527 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.422 HD22 ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -65.67 -47.2 76.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.384 1.088 . . . . 0.0 109.165 177.811 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.422 ' N ' HD22 ' B' ' 31' ' ' ASN . 1.5 t -59.49 -45.23 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.051 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.885 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.61 -37.2 12.09 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.764 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.033 HD13 HD21 ' A' ' 15' ' ' LEU . 10.9 mt -81.43 -27.86 34.51 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -81.28 -13.67 58.21 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -178.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -117.46 29.67 7.74 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 118.002 0.365 . . . . 0.0 111.865 178.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.525 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 24.0 t80 -124.16 157.55 34.45 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.792 0.329 . . . . 0.0 111.649 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.464 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.016 -0.992 . . . . 0.0 112.164 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 120.367 0.127 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -82.83 120.89 26.22 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.5 mm? -131.18 151.39 51.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.625 -178.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.928 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -128.59 123.86 34.42 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.501 178.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.954 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.0 pt -146.76 176.18 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -178.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.623 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.9 t-105 -95.65 102.46 14.26 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -177.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.829 HD11 HG22 ' B' ' 30' ' ' ILE . 0.9 OUTLIER -129.63 112.08 13.33 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.571 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 11.2 p -79.65 -178.27 6.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.895 0.855 . . . . 0.0 112.697 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -49.6 -56.43 10.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.8 -1.546 . . . . 0.0 113.036 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -44.96 -33.81 2.16 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.912 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t -96.87 -22.23 17.02 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 8' ' ' SER . 66.2 mt -73.66 -39.9 64.11 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 175.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.72 -40.17 96.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.452 175.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.912 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t0 -50.42 -45.49 55.8 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.466 177.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.941 HD21 HD13 ' B' ' 34' ' ' LEU . 19.3 mt -89.75 30.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.833 179.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.571 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -113.53 -50.36 2.85 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.571 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 53.6 mttm -88.66 -29.92 19.55 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.145 179.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.506 ' O ' ' HG3' ' A' ' 18' ' ' MET . 1.1 ptt? -99.13 15.94 24.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.682 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.523 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -99.57 -18.73 17.22 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 . . . . . 0 C--N 1.317 -0.831 0 O-C-N 121.428 -0.795 . . . . 0.0 110.107 -179.595 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.628 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 122.654 1.216 . . . . 0.0 114.214 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -55.81 152.86 9.14 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.002 -1.454 . . . . 0.0 110.602 179.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -41.79 2.95 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 120.571 0.224 . . . . 0.0 111.208 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.613 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.1 m -76.64 -51.38 11.67 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.568 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.4 mt-10 -54.53 -35.74 63.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.693 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.901 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -59.36 -45.58 91.01 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.802 1.763 . . . . 0.0 108.845 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.002 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -66.36 -20.79 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.711 0 CA-C-N 112.953 -1.931 . . . . 0.0 112.713 -177.998 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.552 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -80.39 -47.76 13.93 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.348 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.83 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -58.74 -32.08 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.095 0 CA-C-O 121.681 0.753 . . . . 0.0 109.138 178.468 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 1.055 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.1 -47.15 1.51 Allowed 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 113.741 -1.572 . . . . 0.0 111.225 178.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.093 HD13 HD21 ' B' ' 15' ' ' LEU . 9.3 mt -81.53 -25.02 36.26 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.74 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.433 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -91.78 -8.62 46.24 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 1.055 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -125.78 16.31 8.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.732 0.413 . . . . 0.0 111.965 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.778 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -87.9 137.53 32.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.118 0.567 . . . . 0.0 111.686 -179.194 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.601 -0.714 . . . . 0.0 111.324 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -81.43 120.48 25.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' B' ' 3' ' ' LEU . 2.8 mm? -128.45 145.17 51.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.659 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.928 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -124.4 123.16 39.56 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.484 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.897 ' CD1' HG21 ' A' ' 30' ' ' ILE . 2.6 pt -147.76 -179.35 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.614 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.1 t-105 -98.98 102.51 14.26 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -176.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 1.002 HD11 HG22 ' A' ' 30' ' ' ILE . 1.8 mm? -129.44 109.56 11.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 13.2 t -78.23 -132.5 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . 0.86 ' O ' HG22 ' B' ' 11' ' ' THR . 0.8 OUTLIER -90.7 -155.52 0.39 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.575 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . 0.457 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.8 mm-40 37.73 45.71 0.67 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.579 0.751 . . . . 0.0 112.637 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.86 HG22 ' O ' ' B' ' 9' ' ' ASP . 9.3 t -179.17 -47.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.936 178.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.495 HD11 ' O ' ' B' ' 7' ' ' LEU . 38.4 mt -69.17 -40.3 78.21 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -68.98 -39.12 79.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.275 176.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.732 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 3.2 t70 -47.96 -33.67 8.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.539 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.093 HD21 HD13 ' A' ' 34' ' ' LEU . 57.9 mt -64.68 -5.3 5.43 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.47 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 14.5 mt-10 -62.4 -55.87 23.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.228 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.3 pttm -79.78 1.11 27.98 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.154 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 1.013 ' HE2' HD23 ' B' ' 15' ' ' LEU . 12.0 mtm -107.43 -83.11 0.54 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 111.609 0.226 . . . . 0.0 111.609 -179.154 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.744 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -43.53 -43.61 5.6 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 16.6 mtp85 -70.2 -66.0 0.65 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.976 0.417 . . . . 0.0 111.461 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.26 -32.45 37.27 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.283 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' B' ' 18' ' ' MET . 21.9 mm-40 -88.44 -10.54 48.8 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.295 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.86 7.3 80.69 Favored Glycine 0 C--N 1.339 0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.502 -178.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.744 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 96.2 mt -80.27 171.51 14.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.578 0.704 . . . . 0.0 111.408 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -112.19 165.0 12.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.404 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.6 -40.0 5.43 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.0 m -83.32 -52.23 6.74 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.428 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.2 mt-10 -63.79 -11.04 23.36 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.756 -0.202 . . . . 0.0 110.958 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.983 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.0 tpt -85.16 -47.05 10.51 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 122.742 1.258 . . . . 0.0 107.704 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.954 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.6 OUTLIER -75.13 -32.59 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.04 0 CA-C-N 112.889 -1.959 . . . . 0.0 113.216 -178.008 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.466 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -70.32 -50.45 39.07 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.121 0.962 . . . . 0.0 109.449 178.181 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.466 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -55.97 -42.9 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 113.219 -1.809 . . . . 0.0 110.264 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.941 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -49.44 -30.88 8.72 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.288 -1.323 . . . . 0.0 112.232 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.941 HD13 HD21 ' A' ' 15' ' ' LEU . 10.8 mt -89.66 -32.88 16.85 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -177.202 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -72.12 -13.45 61.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -116.52 40.84 2.8 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.632 ' HD1' ' CE1' ' A' ' 36' ' ' HIS . 63.0 t80 -83.5 163.73 20.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.9 -178.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.563 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.282 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.846 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.063 0.459 . . . . 0.0 111.757 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -105.01 113.79 27.6 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.4 tp -122.71 142.57 50.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.944 -178.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.841 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -123.68 129.58 51.34 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.121 178.486 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.76 HD11 HG21 ' B' ' 30' ' ' ILE . 2.1 pt -148.67 179.22 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.422 ' O ' ' HB3' ' B' ' 27' ' ' SER . 71.1 t-105 -96.2 90.41 5.48 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.736 HD21 ' CD1' ' A' ' 5' ' ' ILE . 1.9 mm? -119.16 101.26 7.87 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.46 ' HA ' ' HB2' ' B' ' 1' ' ' ARG . 51.6 p -74.76 -135.2 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.187 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.44 -156.68 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.338 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 34.32 43.68 0.09 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.355 0.662 . . . . 0.0 112.465 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.704 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -172.19 -48.88 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.932 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 7' ' ' LEU . 15.3 mt -75.85 -41.25 52.96 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -77.17 -39.99 46.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.317 176.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.704 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -51.05 -24.75 4.09 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.078 178.549 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.199 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -77.45 41.96 0.33 Allowed 'General case' 0 N--CA 1.424 -1.767 0 C-N-CA 124.24 1.016 . . . . 0.0 112.637 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.687 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -91.15 -47.91 7.26 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.342 179.926 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.687 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 5.3 mtpm? -102.88 24.8 10.14 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.638 ' HB2' HD13 ' A' ' 15' ' ' LEU . 16.6 mtp -116.51 -86.05 0.62 Allowed 'General case' 0 C--O 1.223 -0.34 0 O-C-N 122.172 -0.33 . . . . 0.0 111.201 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.708 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -42.0 -45.43 3.85 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.133 0.573 . . . . 0.0 111.188 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HD2' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.382 0 CA-C-O 121.147 0.498 . . . . 0.0 111.476 179.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.708 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 98.4 mt . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.579 0.704 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -116.96 168.6 10.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.371 177.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.437 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -45.41 -37.89 5.5 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.066 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.437 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 58.8 m -80.39 -57.39 3.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.442 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HB3' HD22 ' A' ' 24' ' ' LEU . 1.8 mm-40 -60.75 -16.21 37.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.137 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 1.199 ' SD ' HD11 ' A' ' 15' ' ' LEU . 2.4 tpt -82.15 -45.61 14.92 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-O 123.704 1.716 . . . . 0.0 107.853 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.807 HG21 HG12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -66.2 -19.48 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.99 0 CA-C-N 113.355 -1.748 . . . . 0.0 111.615 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.439 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -78.1 -53.29 7.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.91 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -51.69 -32.51 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.711 0 CA-C-O 121.584 0.707 . . . . 0.0 109.548 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.953 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -40.05 -43.39 1.57 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.93 -1.486 . . . . 0.0 111.064 177.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.897 HD22 HD21 ' B' ' 15' ' ' LEU . 6.8 mt -80.67 -29.08 36.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.824 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' A' ' 32' ' ' VAL . 8.8 mt-30 -79.08 -30.69 44.03 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.953 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 10.0 p-80 -92.05 -35.67 13.8 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 119.049 0.841 . . . . 0.0 111.895 178.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.67 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 8.1 t80 -46.53 140.44 4.34 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.607 0.242 . . . . 0.0 111.179 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.468 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 117.972 -1.013 . . . . 0.0 112.108 178.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.46 ' HB2' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.384 0.135 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -82.32 119.45 24.14 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -126.37 134.25 51.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.525 -178.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.841 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -112.25 131.01 55.73 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.032 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.807 HG12 HG21 ' A' ' 30' ' ' ILE . 2.5 pp -153.73 169.98 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.581 ' O ' HD12 ' B' ' 7' ' ' LEU . 73.7 t-105 -89.04 100.44 13.22 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -178.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.802 HD13 HD13 ' B' ' 5' ' ' ILE . 1.9 mp -135.17 114.66 12.56 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.846 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -91.93 -169.86 2.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.095 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -43.41 -60.09 1.86 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.126 -1.397 . . . . 0.0 112.869 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.58 -24.72 0.94 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.642 ' HB ' HD12 ' A' ' 34' ' ' LEU . 20.4 p -103.34 -27.41 12.47 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' B' ' 8' ' ' SER . 35.7 mt -74.22 -40.57 62.36 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -62.73 -41.04 98.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.34 176.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.616 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -48.91 -40.41 29.88 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.522 179.132 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.032 HD22 ' CG ' ' B' ' 29' ' ' MET . 26.3 mt -78.83 32.34 0.2 Allowed 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 44.9 mt-10 -103.1 -55.09 2.48 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.468 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 50.2 mttp -81.49 -25.15 36.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.433 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.837 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 9.5 mtm -86.2 -21.91 27.23 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.3 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.718 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.95 -68.4 0.83 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.828 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -57.8 -66.38 0.48 Allowed 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.011 0.434 . . . . 0.0 112.067 -179.599 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . 0.468 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -49.53 -34.18 16.72 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.368 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.52 ' HB2' ' O ' ' B' ' 18' ' ' MET . 20.2 mm-40 -85.08 -10.7 56.59 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.243 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.03 -7.47 81.26 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.752 -178.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.718 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 73.8 mt -74.53 173.83 9.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.606 0.717 . . . . 0.0 111.596 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.3 p -119.05 166.01 13.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.582 178.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.67 -39.67 3.73 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' TRP . 1.4 m -84.14 -54.07 5.08 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 121.961 0.104 . . . . 0.0 111.19 -179.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.03 -8.79 5.8 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.648 0.261 . . . . 0.0 111.113 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 1.032 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.5 tpt -85.91 -47.96 9.16 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.76 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -75.63 -30.92 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.995 0 CA-C-N 113.003 -1.908 . . . . 0.0 113.283 -177.726 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.456 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -69.97 -49.83 47.84 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.263 1.03 . . . . 0.0 109.297 177.629 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.428 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -58.34 -43.13 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.082 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.736 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -46.23 -41.9 13.52 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.563 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.738 HD21 ' HB2' ' A' ' 33' ' ' ALA . 8.5 mt -80.25 -28.62 38.42 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.157 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -70.62 -17.65 62.88 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -119.39 42.98 2.73 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.046 0.45 . . . . 0.0 110.903 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.633 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 69.6 t80 -55.95 172.63 0.18 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.645 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.429 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.155 0 C-N-CA 123.569 0.748 . . . . 0.0 111.961 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.655 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 120.93 0.395 . . . . 0.0 111.825 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 76.1 m95 -114.91 107.29 15.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.582 177.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -122.15 140.67 52.27 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.294 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -106.94 135.36 48.63 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.486 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.875 HD12 HD21 ' A' ' 7' ' ' LEU . 1.1 pt -151.65 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.602 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.3 t-105 -95.12 89.37 5.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.875 HD21 HD12 ' A' ' 5' ' ' ILE . 1.6 mm? -129.24 100.94 5.78 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.592 ' O ' HG22 ' A' ' 11' ' ' THR . 12.7 p -69.67 -171.55 0.4 Allowed 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 122.028 0.918 . . . . 0.0 112.651 -177.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.31 -39.16 82.16 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.209 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.636 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 31.2 mt-30 -75.63 42.19 0.22 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.679 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.676 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 1.3 t -169.3 -31.87 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.85 HD22 HD22 ' B' ' 3' ' ' LEU . 16.7 mt -82.77 -43.08 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 177.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.9 -29.19 18.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.554 -1.657 . . . . 0.0 110.015 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.676 ' HB2' ' N ' ' A' ' 11' ' ' THR . 14.4 t70 -46.46 -13.58 0.02 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.709 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.014 HD11 HD13 ' B' ' 34' ' ' LEU . 0.0 OUTLIER -140.14 46.45 1.84 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 179.224 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 6.3 mt-10 -49.67 -28.61 6.13 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 178.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -71.8 -48.12 48.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.989 ' HE3' ' HG ' ' A' ' 15' ' ' LEU . 16.0 mtm -59.08 -28.75 66.77 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.698 0.285 . . . . 0.0 111.331 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.77 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -98.79 -60.32 1.56 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.0 mtp85 . . . . . 0 CA--C 1.517 -0.311 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.892 HD12 ' O ' ' A' ' 18' ' ' MET . 82.9 mt . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 121.686 0.755 . . . . 0.0 111.512 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' A' ' 29' ' ' MET . 52.2 p -117.43 165.47 13.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.025 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 mttm -47.7 -37.88 13.99 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.585 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.2 m -85.55 -50.81 6.94 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.16 -11.32 8.56 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.939 0.149 . . . . 0.0 111.055 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.829 ' HG2' HD21 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -84.27 -42.31 15.99 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.029 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.772 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -77.28 -39.63 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.254 0 CA-C-N 112.901 -1.954 . . . . 0.0 113.269 -176.974 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.432 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -58.01 -46.2 85.65 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.325 1.059 . . . . 0.0 108.337 176.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.432 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -58.81 -43.48 88.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.062 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.804 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -60.46 -38.13 83.21 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.796 178.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.018 HD13 HD21 ' B' ' 15' ' ' LEU . 16.7 mt -70.3 -26.68 63.9 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.181 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.521 ' HG2' ' CE1' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -78.74 -30.19 45.67 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.129 -178.441 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.521 ' CE1' ' HG2' ' A' ' 35' ' ' GLN . 1.9 m80 -120.1 32.74 5.9 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.543 0.61 . . . . 0.0 111.375 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.576 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -83.26 132.21 35.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 122.476 -0.14 . . . . 0.0 110.657 179.326 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.548 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.483 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.526 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -78.81 116.63 19.27 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.85 HD22 HD22 ' A' ' 12' ' ' LEU . 1.7 tp -138.44 148.96 44.99 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.241 -178.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -107.04 134.93 49.44 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.399 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.828 ' CD1' HD21 ' B' ' 7' ' ' LEU . 4.3 pt -136.83 170.46 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.72 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.2 t-105 -97.11 102.33 14.08 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.828 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.4 OUTLIER -131.81 113.16 13.16 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.662 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.655 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 15.7 p -76.18 -173.9 2.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 112.025 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -48.52 -62.12 1.66 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.352 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -50.85 -28.89 10.43 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.61 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 69.3 p -88.01 -32.63 18.72 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' B' ' 8' ' ' SER . 67.9 mt -68.64 -40.45 80.29 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 177.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.85 -42.72 98.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 113.538 -1.664 . . . . 0.0 107.771 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.639 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -55.51 -46.74 76.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.092 178.589 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.028 HD22 ' CG ' ' B' ' 29' ' ' MET . 15.0 mt -73.24 25.89 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 43.5 mt-10 -111.49 -56.59 2.36 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.68 -29.57 61.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.845 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 21.4 mtm -82.99 -22.35 33.69 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.772 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.717 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.73 -69.06 0.78 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.558 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.4 mtp85 -55.53 -64.24 0.91 Allowed 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.33 -32.44 17.18 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.192 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' B' ' 18' ' ' MET . 3.8 mm-40 -89.68 -4.92 57.52 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.403 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.26 -11.02 61.83 Favored Glycine 0 C--N 1.34 0.768 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.953 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.717 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 74.8 mt -72.07 172.75 9.53 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.743 0.782 . . . . 0.0 111.685 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 89.8 p -119.87 164.28 16.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.253 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.418 ' HB3' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -43.55 -36.05 1.93 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.35 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.437 ' CB ' ' H ' ' A' ' 6' ' ' TRP . 1.4 m -83.51 -56.48 3.72 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 122.221 0.208 . . . . 0.0 111.363 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.471 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.3 mt-10 -62.48 -8.56 6.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.495 178.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 1.028 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.3 tpt -86.0 -48.59 8.53 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.754 HD11 HD11 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -73.08 -35.12 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.044 0 CA-C-N 112.966 -1.925 . . . . 0.0 112.976 -178.051 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.456 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -66.55 -49.41 66.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 122.021 0.915 . . . . 0.0 109.155 177.503 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -57.3 -42.33 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 113.393 -1.73 . . . . 0.0 111.932 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.806 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -48.86 -39.68 26.65 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.429 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.014 HD13 HD11 ' A' ' 15' ' ' LEU . 9.2 mt -76.65 -35.83 57.73 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.196 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -11.12 60.46 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -106.87 -50.53 3.09 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.947 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.615 ' CD2' ' SD ' ' A' ' 18' ' ' MET . 12.0 t80 -44.12 144.58 0.92 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.264 0.352 . . . . 0.0 110.9 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.47 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.012 -0.995 . . . . 0.0 112.14 178.172 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 120.933 0.397 . . . . 0.0 111.881 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.403 ' C ' HD22 ' A' ' 3' ' ' LEU . 98.4 m95 -89.02 122.83 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.044 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.497 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 3.2 mm? -130.08 153.8 48.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.896 -178.586 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' B' ' 3' ' ' LEU . 0.5 OUTLIER -127.76 129.72 47.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.409 178.898 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.825 HD12 HD21 ' A' ' 7' ' ' LEU . 1.3 pt -148.11 -179.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.694 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.574 ' C ' HD22 ' A' ' 7' ' ' LEU . 71.7 t-105 -95.06 91.32 6.29 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -177.264 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.825 HD21 HD12 ' A' ' 5' ' ' ILE . 1.8 mm? -127.46 104.05 7.69 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.451 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.674 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 8.4 t -75.5 -137.4 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 120.557 0.218 . . . . 0.0 110.916 -178.789 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.483 ' O ' HG22 ' A' ' 11' ' ' THR . 1.9 p-10 -84.27 -155.76 0.2 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.963 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.409 ' O ' ' HB ' ' A' ' 11' ' ' THR . 2.1 tt0 36.01 43.11 0.19 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.505 0.722 . . . . 0.0 112.675 178.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.727 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -173.03 -45.38 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.725 178.681 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.644 HD11 ' O ' ' A' ' 7' ' ' LEU . 18.1 mt -78.37 -40.74 35.42 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 175.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -38.84 26.91 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 113.187 -1.824 . . . . 0.0 108.315 177.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.727 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -48.97 -26.47 2.54 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.009 -1.451 . . . . 0.0 110.898 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.94 HD11 ' CE ' ' A' ' 18' ' ' MET . 0.4 OUTLIER -82.13 24.29 0.66 Allowed 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.475 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -66.14 -40.3 90.52 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 122.249 -0.282 . . . . 0.0 110.259 178.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -105.78 -13.68 15.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.94 ' CE ' HD11 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -106.49 5.17 29.03 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 -179.015 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -98.76 -20.95 16.62 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 178.139 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.401 ' HB2' ' NH1' ' A' ' 20' ' ' ARG . 4.4 mtp-105 . . . . . 0 C--N 1.319 -0.741 0 O-C-N 121.62 -0.675 . . . . 0.0 110.112 -179.332 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.578 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 0.6 OUTLIER . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 122.358 1.075 . . . . 0.0 113.483 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -58.66 158.04 8.45 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.833 177.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.14 -40.76 5.21 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.231 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.4 ' CB ' ' H ' ' B' ' 6' ' ' TRP . 3.9 m -77.77 -49.67 13.91 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.482 0.182 . . . . 0.0 111.277 179.991 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.578 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 9.5 mt-10 -55.96 -33.58 64.91 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.353 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.856 ' SD ' ' HG ' ' A' ' 15' ' ' LEU . 5.4 tpt -59.95 -51.91 67.67 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 123.18 1.466 . . . . 0.0 108.848 177.686 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.882 HG21 HD13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -69.39 -29.81 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.587 0 CA-C-N 112.938 -1.937 . . . . 0.0 113.974 -177.265 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.427 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -70.44 -49.46 48.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.198 0.999 . . . . 0.0 108.882 176.706 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.491 HG21 HD11 ' A' ' 24' ' ' LEU . 1.4 t -56.33 -42.26 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.307 0 CA-C-N 113.093 -1.867 . . . . 0.0 111.434 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.895 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -48.44 -43.33 34.29 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.106 179.169 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.027 HD13 ' CD2' ' B' ' 15' ' ' LEU . 11.7 mt -70.73 -29.7 66.02 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.943 -178.141 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -76.92 -23.27 52.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.435 ' HB3' ' HB2' ' B' ' 38' ' ' LYS . 37.0 m80 -118.87 7.83 11.61 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 178.816 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.665 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.4 OUTLIER -61.96 138.05 58.32 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.168 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 117.883 -1.056 . . . . 0.0 112.334 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.674 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 2.1 ttt85 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -72.45 125.07 26.5 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.549 HD22 HD22 ' A' ' 12' ' ' LEU . 2.4 tp -126.37 141.24 51.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.732 -178.479 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.498 ' O ' HG23 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -119.82 131.8 55.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.343 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.046 ' CD1' HD21 ' B' ' 7' ' ' LEU . 1.2 pp -157.19 173.05 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 121.05 0.452 . . . . 0.0 112.142 -178.434 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.646 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.8 t-105 -88.61 109.52 20.16 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 1.046 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.4 OUTLIER -130.91 122.02 26.22 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.085 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 33.7 t -78.03 -126.57 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -178.68 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . 0.514 ' O ' ' HB3' ' B' ' 13' ' ' GLU . 12.4 t70 -105.06 -44.05 4.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.195 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.42 39.82 0.1 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.118 0.485 . . . . 0.0 111.618 -179.412 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.744 ' OG1' HD12 ' A' ' 34' ' ' LEU . 5.1 t -159.5 -41.34 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 179.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.929 HD21 ' HB2' ' B' ' 7' ' ' LEU . 50.3 mt -72.96 -41.86 63.99 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 176.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' B' ' 9' ' ' ASP . 0.1 OUTLIER -73.37 -38.29 65.74 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.196 -1.82 . . . . 0.0 107.365 176.793 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.688 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.2 t70 -47.74 -36.89 12.18 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.743 -1.571 . . . . 0.0 110.45 179.066 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.027 ' CD2' HD13 ' A' ' 34' ' ' LEU . 45.7 mt -68.71 -10.92 59.23 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -179.592 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.35 -59.62 4.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.662 0.268 . . . . 0.0 110.927 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.57 -19.04 64.45 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.91 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.734 ' CE ' HD23 ' B' ' 15' ' ' LEU . 39.1 mtm -89.98 -77.01 0.41 Allowed 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.247 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.515 ' HA ' ' OE2' ' B' ' 22' ' ' GLU . . . -37.09 -41.52 0.37 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.138 0.575 . . . . 0.0 112.324 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -68.91 -71.02 0.24 Allowed 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.847 0.356 . . . . 0.0 111.497 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -29.81 45.79 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.08 179.326 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.67 ' CD ' HD12 ' B' ' 24' ' ' LEU . 3.9 pt-20 -83.71 -15.72 47.62 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.482 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.52 12.02 84.69 Favored Glycine 0 C--N 1.344 1.008 0 C-N-CA 121.214 -0.517 . . . . 0.0 114.011 178.416 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.67 HD12 ' CD ' ' B' ' 22' ' ' GLU . 65.1 mt -102.35 175.18 5.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.553 0.692 . . . . 0.0 111.668 -179.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 68.5 p -106.3 164.56 11.92 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.904 -1.043 . . . . 0.0 109.749 178.502 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.05 -39.04 1.12 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.352 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.526 ' O ' HD11 ' A' ' 7' ' ' LEU . 1.2 m -81.15 -59.44 2.65 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 122.028 0.131 . . . . 0.0 111.3 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -57.76 -14.87 6.5 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.726 0.298 . . . . 0.0 110.922 179.036 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.98 ' CG ' HD22 ' B' ' 15' ' ' LEU . 1.7 tpt -78.41 -46.28 20.26 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 122.73 1.252 . . . . 0.0 107.996 177.743 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.903 HD11 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.45 -29.7 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.109 0 CA-C-N 112.918 -1.946 . . . . 0.0 113.66 -177.605 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.528 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -70.26 -49.99 44.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.325 1.059 . . . . 0.0 109.009 177.329 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.432 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.9 t -56.71 -43.73 79.92 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 CA-C-N 112.958 -1.928 . . . . 0.0 110.967 -179.378 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.758 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -45.54 -39.34 7.34 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.341 179.072 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.895 HD23 ' CB ' ' A' ' 33' ' ' ALA . 8.8 mt -75.97 -32.25 59.4 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.167 -177.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -79.92 -11.41 59.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -125.49 36.96 4.46 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.255 0.55 . . . . 0.0 111.05 177.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.742 ' HD1' ' N ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -58.37 130.08 45.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.362 178.86 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.742 ' N ' ' HD1' ' B' ' 37' ' ' TYR . 7.1 mmpt? . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.58 176.051 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.779 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.803 0.335 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.446 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.2 m95 -79.01 166.99 21.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.2 tp -176.76 145.49 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.099 -179.49 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.717 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -102.27 140.42 36.58 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.616 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.955 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.4 pt -148.47 175.46 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.268 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.679 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 75.4 t-105 -101.15 105.75 16.93 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.772 HD21 HG13 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -127.2 120.28 28.4 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.728 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 t -82.36 -129.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -178.806 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -102.77 -40.96 6.35 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.536 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.89 41.69 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.232 0.539 . . . . 0.0 111.522 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.86 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.0 t -164.41 -44.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.347 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.645 HD21 ' HB2' ' A' ' 7' ' ' LEU . 84.3 mt -63.9 -40.37 96.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.407 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -64.32 -42.13 96.46 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.429 -1.714 . . . . 0.0 108.132 176.403 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.86 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.3 OUTLIER -51.38 -41.33 60.61 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.356 178.244 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.006 HD21 HD13 ' B' ' 34' ' ' LEU . 24.6 mt -83.96 32.72 0.48 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.98 179.789 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -107.57 -69.35 0.85 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? -76.99 -25.69 53.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.405 179.079 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.615 ' HE1' ' HB3' ' B' ' 34' ' ' LEU . 0.9 OUTLIER -94.52 8.02 43.6 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.54 179.796 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.516 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -100.29 -17.97 17.04 Favored 'General case' 0 C--O 1.214 -0.785 0 C-N-CA 122.954 0.502 . . . . 0.0 112.199 178.894 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.814 0 O-C-N 121.592 -0.693 . . . . 0.0 109.866 -179.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.565 ' CB ' ' HB3' ' A' ' 28' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 122.606 1.193 . . . . 0.0 114.147 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.06 154.11 13.37 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.516 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -42.69 8.84 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-O 120.438 0.161 . . . . 0.0 111.209 -179.685 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.659 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 5.9 m -75.65 -44.63 41.58 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.919 179.26 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.9 OUTLIER -62.4 -37.32 85.31 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.509 179.513 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.959 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -57.99 -43.52 86.62 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 124.125 1.917 . . . . 0.0 108.36 177.058 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.086 HG21 HD12 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -68.61 -16.3 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.911 0 CA-C-N 112.583 -2.099 . . . . 0.0 112.949 -177.778 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -86.83 -45.13 11.17 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.821 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -59.0 -31.4 45.54 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.635 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 1.032 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -38.08 -46.84 1.06 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.319 177.951 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.893 HD13 ' CD2' ' B' ' 15' ' ' LEU . 8.1 mt -82.68 -26.56 31.98 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.653 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -87.84 -13.75 41.29 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -179.789 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 1.032 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -117.9 4.09 12.18 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 179.699 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.648 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.8 t80 -76.56 146.38 38.39 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.8 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.202 179.442 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -90.7 105.1 17.59 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.732 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.45 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 1.9 tp -125.26 145.64 49.9 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.251 -177.77 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.717 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -103.27 136.91 42.17 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 177.627 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.086 HD12 HG21 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -149.53 -175.0 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.015 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.659 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 64.8 t-105 -92.62 91.0 7.35 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.396 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.975 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -125.2 95.08 4.36 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.601 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.779 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 51.2 p -64.73 177.82 0.88 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 121.761 0.791 . . . . 0.0 111.853 -178.377 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -54.19 -52.65 60.55 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.649 -179.744 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -55.68 -26.88 47.11 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -179.169 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.673 ' HB ' HD12 ' A' ' 34' ' ' LEU . 37.1 p -82.97 -30.29 28.38 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.286 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' B' ' 8' ' ' SER . 30.0 mt -73.77 -39.33 64.26 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 178.619 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.8 mt-10 -60.15 -41.29 92.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 113.719 -1.582 . . . . 0.0 107.612 175.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.51 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -53.21 -39.91 64.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.192 -1.367 . . . . 0.0 110.537 178.603 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.061 HD22 ' CG ' ' B' ' 29' ' ' MET . 30.9 mt -77.75 28.4 0.17 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.535 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -101.01 -49.58 4.07 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.657 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.535 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 57.0 mttm -84.61 -20.81 30.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.58 179.25 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.888 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.6 mtm -91.93 -21.04 20.79 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.612 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.698 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -102.66 -62.25 1.3 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.253 179.714 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 4.8 mtp-105 -62.21 -64.94 0.77 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.962 0.41 . . . . 0.0 111.691 -179.487 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -33.4 21.83 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.286 179.78 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.516 ' HB2' ' O ' ' B' ' 18' ' ' MET . 22.3 mm-40 -85.77 -11.57 53.19 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.292 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.1 -6.02 84.08 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.791 -178.428 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.698 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.1 mt -74.08 174.69 8.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.57 0.7 . . . . 0.0 111.529 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 23.1 p -116.95 168.88 9.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.665 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -47.52 -41.17 20.45 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.322 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.679 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 80.8 p -84.62 -49.74 8.29 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.889 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.49 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.8 mm-40 -64.35 -7.95 11.41 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.628 0.251 . . . . 0.0 110.77 178.805 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 1.061 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.7 tpt -85.88 -48.03 9.12 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 122.741 1.258 . . . . 0.0 107.804 177.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.955 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -75.89 -38.0 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.041 0 CA-C-N 112.907 -1.951 . . . . 0.0 113.189 -177.744 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.423 HD22 ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -63.69 -46.91 83.38 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.324 1.059 . . . . 0.0 109.092 177.967 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.49 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -61.62 -43.41 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.627 -179.104 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.905 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.89 -30.5 4.19 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.932 179.797 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.006 HD13 HD21 ' A' ' 15' ' ' LEU . 12.1 mt -90.44 -30.48 17.32 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -177.145 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -71.65 -17.33 62.26 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -110.99 39.06 2.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.568 ' HD2' ' CE1' ' A' ' 36' ' ' HIS . 51.0 t80 -86.08 160.02 19.4 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.792 -178.61 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.2 mppt? . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.576 178.351 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.505 ' CB ' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.934 0.397 . . . . 0.0 111.807 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -87.23 165.07 15.96 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.697 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.655 HD22 HD22 ' B' ' 12' ' ' LEU . 2.6 tp -167.94 147.12 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.631 -179.411 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.713 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -125.26 135.77 52.87 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.969 178.97 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.929 HD12 HG21 ' B' ' 30' ' ' ILE . 0.3 OUTLIER -151.22 -174.84 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -178.724 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.78 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 67.5 t-105 -97.03 95.57 7.89 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.817 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.825 HD11 ' CG2' ' B' ' 30' ' ' ILE . 1.2 mm? -126.78 103.72 7.68 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.55 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.804 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.2 OUTLIER -95.84 -171.38 2.33 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.636 0.732 . . . . 0.0 112.661 -177.442 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -43.3 -56.44 3.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.227 -1.351 . . . . 0.0 112.367 -178.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -50.03 -28.51 7.14 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.159 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.696 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 19.8 p -97.39 -28.49 13.99 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.406 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 8' ' ' SER . 21.4 mt -75.49 -40.94 56.62 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 178.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.525 ' O ' ' HB3' ' A' ' 16' ' ' GLU . 2.9 mt-10 -65.79 -40.31 91.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 113.766 -1.561 . . . . 0.0 108.076 176.103 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.696 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -47.55 -45.29 26.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.59 179.039 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.855 HD12 ' HB2' ' A' ' 19' ' ' ALA . 3.5 mm? -77.43 16.73 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -178.542 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.57 ' CG ' ' HG2' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -74.12 -46.9 39.73 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.632 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.57 ' HG2' ' CG ' ' A' ' 16' ' ' GLU . 1.5 mmtm -96.88 1.95 51.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.612 179.029 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.733 ' HB2' HD13 ' A' ' 15' ' ' LEU . 5.0 mtm -108.06 -74.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.983 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.855 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -53.46 -50.7 64.74 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.572 0.349 . . . . 0.0 111.827 -178.911 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.51 -0.592 0 CA-C-O 121.14 0.495 . . . . 0.0 110.481 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.744 HD23 ' C ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.378 0 CA-C-O 121.184 0.516 . . . . 0.0 111.959 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.8 p -96.82 164.32 12.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.446 178.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 29' ' ' MET . 10.9 mttm -46.2 -32.14 2.84 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.763 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.626 ' HA ' HD12 ' B' ' 5' ' ' ILE . 6.7 p -77.2 -50.55 12.7 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.853 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 32' ' ' VAL . 10.8 mt-10 -55.74 -24.43 35.14 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.851 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.819 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -78.12 -42.33 32.28 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 121.925 0.869 . . . . 0.0 109.029 178.658 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.766 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -78.25 -23.15 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.477 0 CA-C-N 114.195 -1.366 . . . . 0.0 113.359 -176.699 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -72.87 -53.34 11.67 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.749 0.785 . . . . 0.0 109.13 176.288 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.585 HG12 ' O ' ' A' ' 28' ' ' GLU . 12.7 p -61.99 -30.89 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.962 0 CA-C-N 114.128 -1.396 . . . . 0.0 112.594 -177.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.777 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -42.37 -37.69 1.63 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.451 177.879 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.128 HD13 HD23 ' B' ' 15' ' ' LEU . 8.4 mt -87.89 -29.37 20.92 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.837 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -69.72 -59.46 2.93 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -177.523 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.783 ' NE2' ' HB2' ' B' ' 37' ' ' TYR . 9.7 p-80 -56.93 -36.16 69.91 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 119.158 0.89 . . . . 0.0 111.973 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.739 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 10.4 t80 -42.17 145.73 0.35 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 -177.499 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.249 1.039 0 C-N-CA 124.279 1.031 . . . . 0.0 112.769 178.299 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.804 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 120.992 0.425 . . . . 0.0 111.829 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -108.93 116.19 31.52 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 177.55 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.497 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.12 144.66 51.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.388 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.713 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.02 133.35 56.11 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.502 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 27' ' ' SER . 0.9 OUTLIER -149.59 -177.71 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.468 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -91.17 87.64 6.61 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -177.094 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.766 HD11 HG22 ' A' ' 30' ' ' ILE . 1.9 mm? -119.81 101.43 7.88 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.814 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.505 ' HA ' ' CB ' ' A' ' 1' ' ' ARG . 48.0 t -67.05 -117.69 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.67 -178.188 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.24 -147.35 0.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.266 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . 0.473 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.5 tm0? 34.36 44.4 0.1 Allowed 'General case' 0 C--N 1.346 0.43 0 C-N-CA 123.847 0.859 . . . . 0.0 113.202 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.669 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.0 OUTLIER -177.48 -46.5 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.436 178.971 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.655 HD22 HD22 ' A' ' 3' ' ' LEU . 27.1 mt -73.47 -40.65 63.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -76.95 -37.46 55.23 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 113.297 -1.774 . . . . 0.0 108.161 176.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.669 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -52.32 -20.07 2.5 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.029 178.322 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.128 HD23 HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -71.63 43.96 0.09 Allowed 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 125.172 1.389 . . . . 0.0 112.21 179.323 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -86.73 -58.72 2.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.938 179.537 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -98.02 22.57 9.19 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.261 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.786 ' HB2' HD13 ' B' ' 15' ' ' LEU . 0.5 OUTLIER -103.15 -84.68 0.46 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.663 179.75 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.579 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -49.0 -41.75 35.51 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.018 0.527 . . . . 0.0 111.185 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 mtt-85 -64.35 -67.77 0.41 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.965 0.412 . . . . 0.0 111.078 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -32.65 44.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.969 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' B' ' 18' ' ' MET . 37.8 mt-10 -82.66 -17.15 45.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.945 179.747 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.09 9.41 86.97 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -177.301 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 95.3 mt -88.62 171.48 10.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.555 0.742 . . . . 0.0 111.769 -179.445 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 87.5 p -110.53 163.34 13.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.074 177.578 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -43.25 -38.55 2.62 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.214 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.78 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 69.5 m -83.2 -52.14 6.85 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.631 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.44 -11.58 44.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.132 0.491 . . . . 0.0 110.562 178.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.986 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.9 tpt -81.59 -45.25 16.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 177.306 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.929 HG21 HD12 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -74.52 -25.79 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.689 0 CA-C-N 112.58 -2.1 . . . . 0.0 112.872 -178.13 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.538 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.45 -50.37 69.99 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.842 0.829 . . . . 0.0 109.282 177.508 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.538 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 14.0 p -74.44 -31.26 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.788 -1.551 . . . . 0.0 113.572 -176.868 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.83 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -53.96 -38.41 64.95 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 122.121 0.962 . . . . 0.0 109.235 177.469 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.027 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -77.77 -41.29 38.01 Favored 'General case' 0 N--CA 1.399 -3.009 0 CA-C-N 113.878 -1.51 . . . . 0.0 110.738 -178.768 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . 1.027 ' N ' HD13 ' B' ' 34' ' ' LEU . 5.5 mt-30 -57.12 -62.19 1.93 Allowed 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.186 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.83 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.9 p-80 -53.33 -32.51 49.37 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.854 1.206 . . . . 0.0 110.778 179.695 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.783 ' HB2' ' NE2' ' A' ' 36' ' ' HIS . 62.8 t80 -61.94 160.01 13.08 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.306 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.59 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 10.5 mmmt . . . . . 0 C--O 1.248 0.987 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.85 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.644 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.018 0.437 . . . . 0.0 111.828 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.406 ' C ' HD22 ' A' ' 3' ' ' LEU . 82.3 m95 -114.94 114.6 25.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.132 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.486 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -131.98 154.98 48.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.421 -178.866 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.937 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -124.38 131.55 53.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.788 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.878 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -146.02 176.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.364 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.46 ' C ' HD22 ' A' ' 7' ' ' LEU . 74.0 t-105 -97.88 97.76 9.23 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.155 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.775 HD21 ' CD1' ' A' ' 5' ' ' ILE . 1.5 mm? -121.68 112.16 18.07 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 177.08 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.445 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.4 p -80.16 -145.94 0.05 OUTLIER 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 120.786 0.327 . . . . 0.0 111.411 -178.647 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.69 ' O ' HG22 ' A' ' 11' ' ' THR . 2.5 p-10 -75.87 -159.82 0.12 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.953 -179.087 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.46 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 tt0 36.11 44.87 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.487 0.715 . . . . 0.0 112.62 179.048 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.755 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 12.4 t -176.01 -43.98 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.087 179.167 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.573 HD21 ' HB2' ' A' ' 7' ' ' LEU . 27.8 mt -71.03 -42.28 69.74 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 175.943 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -68.15 -39.5 82.63 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 113.286 -1.779 . . . . 0.0 107.521 176.017 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.755 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.1 t70 -50.21 -36.33 30.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.274 178.803 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.986 ' CD2' HD13 ' B' ' 34' ' ' LEU . 51.3 mt -66.82 6.08 0.54 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -69.16 -61.93 1.59 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.228 -0.295 . . . . 0.0 110.687 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -77.92 -11.3 59.88 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.908 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 9.6 mtm -93.95 -29.57 15.19 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.261 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.771 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -103.98 -64.49 1.1 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.917 -0.129 . . . . 0.0 111.214 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 . . . . . 0 CA--C 1.515 -0.382 0 CA-C-O 121.149 0.5 . . . . 0.0 111.791 -179.61 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.771 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.7 mt . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 121.561 0.696 . . . . 0.0 111.482 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 96.0 p -118.32 163.11 17.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.59 -1.187 . . . . 0.0 109.674 178.622 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.419 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -39.43 -37.84 0.5 Allowed 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.532 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.631 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 3.4 m -83.98 -56.88 3.44 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.425 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.1 mt-10 -61.87 -9.66 7.37 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.675 0.274 . . . . 0.0 110.437 179.017 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.908 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.6 tpt -85.64 -48.34 8.97 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 122.742 1.258 . . . . 0.0 108.057 178.083 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.086 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.03 -39.87 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 112.887 -1.96 . . . . 0.0 112.873 -177.796 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.422 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -60.71 -46.25 91.11 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 122.215 1.007 . . . . 0.0 108.647 177.462 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.422 ' N ' HD22 ' A' ' 31' ' ' ASN . 1.1 t -59.36 -43.11 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 CA-C-N 113.155 -1.838 . . . . 0.0 110.509 179.844 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.775 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -55.34 -33.33 63.27 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.543 178.466 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.848 HD13 HD21 ' B' ' 15' ' ' LEU . 14.2 mt -77.68 -30.15 51.81 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.044 -178.747 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -80.1 -17.04 53.65 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.244 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -110.59 15.15 22.22 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 178.735 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.48 -166.29 0.1 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 122.942 0.497 . . . . 0.0 109.956 178.823 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HD3' ' N ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.489 1.516 . . . . 0.0 112.606 -178.091 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.375 0.131 . . . . 0.0 111.291 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . 0.5 ' C ' HD22 ' B' ' 3' ' ' LEU . 91.8 m95 -84.79 121.25 27.43 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.786 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.5 HD22 ' C ' ' B' ' 2' ' ' TRP . 2.3 mm? -137.36 153.19 50.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 -179.549 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.937 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -115.88 130.57 56.89 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.572 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.086 ' CD1' HG21 ' A' ' 30' ' ' ILE . 4.4 pt -142.4 172.63 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.673 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.2 t-105 -99.6 104.61 16.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -177.446 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.855 HD11 HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -132.39 114.66 14.61 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.554 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.644 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 10.4 p -77.26 -173.55 2.88 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.636 0.732 . . . . 0.0 112.702 -177.954 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -48.29 -62.93 1.23 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.336 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.69 -28.71 9.55 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.551 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.63 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 74.1 p -86.33 -32.2 21.14 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.713 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' B' ' 8' ' ' SER . 52.2 mt -71.33 -39.91 71.08 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 177.916 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -62.44 -41.67 98.9 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 113.469 -1.696 . . . . 0.0 107.793 175.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.7 OUTLIER -54.48 -47.54 72.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.205 178.876 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.848 HD21 HD13 ' A' ' 34' ' ' LEU . 15.2 mt -74.75 27.65 0.09 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -109.15 -55.3 2.43 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.87 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.83 -36.95 41.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.498 178.581 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.714 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 13.6 mtm -73.23 -16.82 61.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.455 178.58 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.812 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.93 -69.17 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.44 -179.485 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -69.41 0.21 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.966 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.46 -32.08 7.26 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.834 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.714 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 2.9 mt-10 -83.86 -24.36 30.9 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.386 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . 0.439 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 99.18 64.04 0.84 Allowed Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.224 -0.988 . . . . 0.0 113.916 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.812 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -179.11 -177.62 0.48 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 177.77 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . 0.588 ' N ' HD23 ' B' ' 24' ' ' LEU . 3.5 t -114.94 174.78 5.8 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.667 -179.149 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.425 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 0.0 OUTLIER -43.84 -38.92 3.56 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.083 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.545 ' HA ' HD12 ' A' ' 5' ' ' ILE . 3.2 p -80.3 -56.0 4.51 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 117.523 0.147 . . . . 0.0 111.351 -179.552 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.683 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.4 mm-40 -62.93 -11.8 21.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.555 0.217 . . . . 0.0 110.534 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.805 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.1 tpt -81.97 -47.6 12.5 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 122.699 1.238 . . . . 0.0 107.736 177.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.878 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -74.31 -37.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.11 0 CA-C-N 112.894 -1.957 . . . . 0.0 112.944 -177.846 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -61.57 -48.38 81.23 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 122.26 1.029 . . . . 0.0 108.543 176.9 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.503 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -58.04 -41.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 CA-C-N 113.015 -1.902 . . . . 0.0 111.561 -179.436 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.764 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -53.16 -37.61 62.03 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.902 179.194 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.986 HD13 ' CD2' ' A' ' 15' ' ' LEU . 15.4 mt -75.56 -31.97 60.23 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.774 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -77.82 -17.79 57.05 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.516 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -96.23 -35.28 11.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 121.259 -0.176 . . . . 0.0 110.99 177.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.545 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 13.4 t80 -40.89 143.09 0.4 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.651 0.38 . . . . 0.0 111.091 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt . . . . . 0 C--O 1.251 1.139 0 C-N-CA 123.587 0.755 . . . . 0.0 112.299 179.035 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.706 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.5 mpt_? . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.917 0.389 . . . . 0.0 111.518 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . 0.415 ' C ' HD22 ' A' ' 3' ' ' LEU . 87.9 m95 -104.68 116.35 31.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.001 178.745 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -133.21 157.4 45.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.72 -179.57 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -113.88 138.41 50.34 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.783 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.572 ' CD1' ' HB2' ' A' ' 7' ' ' LEU . 2.3 pp -154.69 167.5 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.37 0.605 . . . . 0.0 112.351 -178.589 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.521 ' O ' ' HB3' ' B' ' 27' ' ' SER . 68.0 t-105 -79.02 88.69 4.78 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.374 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.615 HD23 HD22 ' B' ' 3' ' ' LEU . 29.9 tp -125.83 84.62 2.29 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.938 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.608 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 47.9 p -63.41 175.39 1.02 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 122.248 1.023 . . . . 0.0 113.631 -177.067 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.99 -44.46 78.61 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 113.186 -1.825 . . . . 0.0 112.709 -179.35 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -40.54 -37.59 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.748 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.762 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.4 t -109.29 -11.03 14.92 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -178.859 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 8' ' ' SER . 66.5 mt -70.05 -38.44 75.82 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 175.881 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.89 -40.79 98.61 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.164 -1.835 . . . . 0.0 107.952 176.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.762 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -53.14 -42.99 66.6 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.461 178.497 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.033 HD21 HD13 ' B' ' 34' ' ' LEU . 28.9 mt -75.86 19.71 0.2 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -99.27 -50.24 4.19 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.28 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -81.37 -33.63 32.24 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.712 178.528 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.525 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 25.0 mtm -67.65 -69.92 0.29 Allowed 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.092 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.748 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -37.27 -44.91 0.62 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.558 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.064 0.459 . . . . 0.0 111.309 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.748 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.883 0 CA-C-O 121.354 0.597 . . . . 0.0 112.346 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.06 169.42 8.45 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.67 -40.2 4.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -179.069 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.808 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 23.9 m -78.08 -56.47 4.45 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.598 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mt-10 -60.54 -18.71 54.02 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.055 0.455 . . . . 0.0 109.838 178.762 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.935 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.2 tpt -71.53 -47.86 52.5 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 123.122 1.439 . . . . 0.0 107.916 177.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.059 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -69.61 -28.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.614 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.155 -178.484 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.427 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -67.08 -49.39 65.19 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.937 0.875 . . . . 0.0 108.946 177.052 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.438 ' HA ' ' NE2' ' A' ' 35' ' ' GLN . 0.9 OUTLIER -57.4 -42.42 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.95 -179.905 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.873 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.87 -39.84 54.95 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.038 178.976 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.099 HD13 HD21 ' B' ' 15' ' ' LEU . 13.5 mt -73.45 -28.98 62.25 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.474 -178.32 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.438 ' NE2' ' HA ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -78.93 -19.76 50.99 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.08 -179.503 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -104.61 -35.89 7.67 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 178.281 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.576 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.3 t80 -30.79 130.87 0.1 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.0 0.52 . . . . 0.0 112.135 -179.753 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.437 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 117.993 -1.003 . . . . 0.0 112.07 177.956 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.608 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.802 0.334 . . . . 0.0 111.523 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -74.78 145.64 42.77 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.322 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.615 HD22 HD23 ' A' ' 7' ' ' LEU . 1.7 tp -158.05 150.63 22.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.165 -178.85 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.3 m -111.02 140.68 45.35 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.059 HD12 HG21 ' A' ' 30' ' ' ILE . 3.7 pt -148.41 179.8 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.98 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.808 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.3 t-105 -99.96 101.41 12.5 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -177.187 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.829 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -133.47 113.1 12.12 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 177.172 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.706 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -89.84 -165.83 1.44 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.415 0.626 . . . . 0.0 112.302 -178.132 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -47.79 -65.4 0.57 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.774 -178.476 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -49.3 -25.38 2.35 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.532 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.699 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 30.2 p -94.65 -38.89 10.62 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.552 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' B' ' 8' ' ' SER . 74.6 mt -63.93 -40.83 97.36 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 178.412 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.33 -43.18 98.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 113.747 -1.57 . . . . 0.0 107.975 176.298 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.699 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.71 -45.28 70.39 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.332 178.751 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.099 HD21 HD13 ' A' ' 34' ' ' LEU . 18.0 mt -72.72 28.36 0.06 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.343 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.524 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 6.2 mm-40 -109.55 -56.28 2.32 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.16 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.489 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 1.1 mttm -75.86 -25.53 56.27 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 178.698 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.855 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.0 mtm -87.04 -23.35 25.0 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.208 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.717 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.34 -67.63 0.85 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -54.07 -67.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 4.8 mmm180 -49.01 -32.31 9.05 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.383 179.717 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.4 mm-40 -88.94 -6.64 57.13 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.466 179.808 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.42 -8.07 69.78 Favored Glycine 0 C--N 1.338 0.687 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.814 -178.526 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.717 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.6 mt -74.12 170.91 14.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.668 0.747 . . . . 0.0 111.605 -179.901 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.6 m -118.62 162.7 17.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.37 178.281 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.458 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -40.55 -37.46 0.71 Allowed 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -179.077 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.521 ' HB3' ' O ' ' A' ' 6' ' ' TRP . 0.7 OUTLIER -82.55 -57.56 3.29 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 122.697 0.399 . . . . 0.0 111.689 -179.538 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.53 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.2 mt-10 -61.69 -10.87 9.59 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.34 178.899 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 1.031 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.5 tpt -83.71 -47.86 10.74 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.769 1.271 . . . . 0.0 107.836 177.955 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.767 HD13 HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -73.64 -33.25 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.09 0 CA-C-N 112.791 -2.004 . . . . 0.0 113.147 -177.906 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.449 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -70.13 -48.7 56.4 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.94 0.876 . . . . 0.0 109.338 177.394 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.2 t -56.22 -40.3 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-N 113.499 -1.682 . . . . 0.0 110.642 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.722 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -53.63 -32.68 52.33 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.482 179.005 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.033 HD13 HD21 ' A' ' 15' ' ' LEU . 11.3 mt -82.36 -32.83 29.09 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.78 -177.825 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -80.54 -8.42 59.57 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -112.17 8.21 19.81 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.488 0.185 . . . . 0.0 111.327 177.665 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.544 ' CD2' ' HD2' ' B' ' 38' ' ' LYS . 3.3 t80 -66.3 -169.29 0.07 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.085 0.554 . . . . 0.0 109.6 178.592 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.544 ' HD2' ' CD2' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.363 1.465 . . . . 0.0 112.915 -178.408 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 120.815 0.34 . . . . 0.0 111.864 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -98.37 114.6 26.99 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.444 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.548 HD21 HG12 ' A' ' 5' ' ' ILE . 3.2 tp -122.25 142.39 50.51 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.266 -177.931 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.6 OUTLIER -123.76 128.77 50.05 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.663 178.217 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 1.028 HD12 HD21 ' A' ' 7' ' ' LEU . 1.1 pp -155.75 173.71 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -178.076 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.674 ' O ' HD13 ' A' ' 7' ' ' LEU . 74.9 t-105 -95.28 112.64 24.32 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -176.83 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.028 HD21 HD12 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -129.52 122.65 29.65 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.519 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.893 ' C ' HD23 ' A' ' 12' ' ' LEU . 9.8 p -80.31 -173.23 3.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.318 0.58 . . . . 0.0 110.412 -179.802 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -61.93 -162.11 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.201 -178.645 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.495 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.54 40.43 0.12 Allowed 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.635 0.774 . . . . 0.0 112.805 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.718 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 2.0 t -179.78 -56.46 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.002 179.441 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.931 HD22 ' HB2' ' B' ' 1' ' ' ARG . 0.6 OUTLIER -62.61 -29.1 70.36 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 175.831 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.458 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 2.8 mm-40 -92.43 -37.5 12.52 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.609 -1.632 . . . . 0.0 108.692 177.201 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.718 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -45.34 -31.03 1.45 Allowed 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.718 179.472 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.99 HD22 ' CG ' ' A' ' 29' ' ' MET . 43.8 mt -72.47 19.21 0.08 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 179.609 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -95.88 -48.6 5.66 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.217 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -84.63 -38.09 20.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.556 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.461 ' O ' ' N ' ' A' ' 20' ' ' ARG . 17.2 mtm -64.26 -72.69 0.14 Allowed 'General case' 0 C--N 1.341 0.239 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.427 179.466 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.518 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -28.5 -32.17 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.888 1.368 . . . . 0.0 113.934 -178.602 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.505 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 3.7 mmm180 . . . . . 0 C--N 1.31 -1.14 0 C-N-CA 119.729 -0.789 . . . . 0.0 110.35 179.194 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 19' ' ' ALA . 1.2 mp . . . . . 0 N--CA 1.454 -0.236 0 CA-C-O 122.319 1.057 . . . . 0.0 113.353 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -60.82 165.21 4.15 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 114.282 -1.326 . . . . 0.0 110.373 178.535 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -43.87 66.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.311 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 m -80.71 -46.92 14.75 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.283 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.576 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 2.5 mm-40 -57.36 -27.49 62.33 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.591 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.99 ' CG ' HD22 ' A' ' 15' ' ' LEU . 4.2 tpt -63.61 -48.3 77.88 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 122.925 1.345 . . . . 0.0 109.109 177.702 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.966 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -77.94 -29.78 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.582 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.128 -176.282 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -71.75 -50.02 33.83 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.052 0.929 . . . . 0.0 109.459 177.785 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.3 t -57.85 -42.86 83.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.817 -179.488 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.936 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -50.51 -27.71 7.12 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.625 179.154 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.928 HD13 HD21 ' B' ' 15' ' ' LEU . 10.9 mt -91.42 -30.91 16.24 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.922 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -75.7 -14.24 60.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.076 0.398 . . . . 0.0 112.076 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -111.04 35.6 3.48 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.491 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.586 ' CD2' ' N ' ' A' ' 38' ' ' LYS . 67.3 t80 -74.31 162.22 29.11 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.341 -178.735 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.586 ' N ' ' CD2' ' A' ' 37' ' ' TYR . 6.8 mmmt . . . . . 0 C--O 1.251 1.136 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.086 177.794 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.931 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 120.785 0.326 . . . . 0.0 111.878 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . 0.437 ' C ' HD22 ' B' ' 3' ' ' LEU . 97.6 m95 -89.56 122.46 32.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.834 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 mm? -133.61 151.07 51.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.958 0.409 . . . . 0.0 111.95 -178.605 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -123.78 124.25 42.28 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.257 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.966 ' CD1' HG21 ' A' ' 30' ' ' ILE . 3.8 pt -147.21 176.99 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.794 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.677 ' O ' HD13 ' B' ' 7' ' ' LEU . 70.6 t-105 -96.9 101.82 13.48 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.268 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.904 HD11 HG22 ' A' ' 30' ' ' ILE . 0.7 OUTLIER -130.85 112.26 12.85 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.476 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.582 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 9.8 p -84.76 178.92 7.46 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.029 0.919 . . . . 0.0 113.028 -177.89 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -47.69 -49.15 28.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 113.321 -1.763 . . . . 0.0 112.781 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -43.46 -35.02 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.527 -178.846 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.771 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 3.9 t -112.28 -7.74 13.99 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -179.202 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' B' ' 8' ' ' SER . 73.8 mt -72.88 -38.96 66.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 175.762 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.54 -41.35 98.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.285 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.771 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -52.2 -43.05 64.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.622 178.794 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.928 HD21 HD13 ' A' ' 34' ' ' LEU . 16.5 mt -79.09 22.88 0.38 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.628 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -43.35 4.48 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -80.71 -46.91 14.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.301 0.24 . . . . 0.0 111.524 179.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.781 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -81.32 10.04 6.2 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.413 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -111.04 -61.06 1.75 Allowed 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.542 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.492 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 29.9 mmm-85 -62.0 -63.51 1.23 Allowed 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.182 0.515 . . . . 0.0 111.505 179.191 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -34.56 35.35 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.844 179.534 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -80.48 -12.65 59.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.673 179.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.59 -12.91 68.69 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.76 -178.666 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.426 HD22 ' HB3' ' B' ' 28' ' ' GLU . 43.4 mt -74.26 175.3 7.72 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.907 0.86 . . . . 0.0 112.22 -179.793 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -118.33 173.29 6.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.166 178.139 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.56 -38.85 60.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 7.3 m -79.79 -52.66 7.64 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.539 0.209 . . . . 0.0 111.029 179.819 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.426 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.7 mm-40 -63.82 -13.52 45.25 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.262 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.786 ' HG2' ' HB3' ' B' ' 15' ' ' LEU . 1.2 tpt -80.84 -45.77 16.37 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 123.714 1.721 . . . . 0.0 107.176 177.129 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 1.022 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.71 -17.91 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.772 0 CA-C-N 112.943 -1.935 . . . . 0.0 111.957 -179.099 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.411 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -80.34 -47.51 14.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.075 176.82 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.754 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.1 OUTLIER -59.25 -30.94 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 CA-C-O 121.665 0.745 . . . . 0.0 108.996 178.549 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 1.034 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -37.42 -44.35 0.63 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 113.722 -1.581 . . . . 0.0 110.924 177.919 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.9 HD22 HD21 ' A' ' 15' ' ' LEU . 9.2 mt -83.78 -30.45 26.59 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.534 -179.392 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' B' ' 32' ' ' VAL . 13.2 mt-30 -82.89 -15.61 50.8 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.426 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 1.034 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 1.0 OUTLIER -118.3 6.06 11.89 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.974 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.679 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 1.0 OUTLIER -78.49 137.84 38.14 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.172 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.451 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 117.931 -1.033 . . . . 0.0 112.025 178.366 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.881 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -88.96 118.39 28.65 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.107 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 mm? -131.85 154.76 48.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.73 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -127.03 135.23 50.53 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 178.775 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 1.028 HD13 HD13 ' A' ' 7' ' ' LEU . 2.3 pp -151.12 171.86 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.898 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.62 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 73.2 t-105 -84.76 91.64 8.02 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.036 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.028 HD13 HD13 ' A' ' 5' ' ' ILE . 2.9 mp -131.45 98.68 4.59 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 177.038 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.83 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -74.07 -168.22 0.6 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.525 0.678 . . . . 0.0 112.127 -177.863 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -55.17 -54.39 43.88 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.478 -1.237 . . . . 0.0 113.078 -178.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -50.35 -22.58 1.89 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.47 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 15.7 p -96.72 -25.46 15.52 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.718 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 8' ' ' SER . 20.0 mt -78.8 -37.33 41.11 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 178.613 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.96 -41.29 78.04 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 174.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.577 ' O ' ' HG3' ' A' ' 18' ' ' MET . 0.1 OUTLIER -55.63 -47.44 76.59 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.683 177.421 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.867 HD21 HD22 ' B' ' 34' ' ' LEU . 22.3 mt -81.32 31.56 0.34 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.829 179.657 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.425 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -113.78 -49.58 2.87 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.687 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.425 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 2.1 ptmm? -88.83 -28.8 20.16 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.613 0.365 . . . . 0.0 111.056 178.577 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.66 ' HE2' HD23 ' A' ' 15' ' ' LEU . 6.9 mtm -87.04 -8.17 57.38 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.567 178.743 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.442 ' O ' ' N ' ' A' ' 24' ' ' LEU . . . -89.69 -18.99 25.37 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.063 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' A' ' 16' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.314 -0.946 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.863 -179.485 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.623 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.66 163.33 3.32 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 113.727 -1.579 . . . . 0.0 110.593 178.692 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -51.13 -43.81 61.24 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.801 0.296 . . . . 0.0 111.801 -179.474 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -77.08 -39.59 49.19 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.543 0.211 . . . . 0.0 111.023 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.623 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.8 mt-10 -64.81 -36.45 84.37 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.282 179.508 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.862 ' HE3' HG23 ' A' ' 32' ' ' VAL . 2.4 tpt -61.3 -44.66 96.84 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 123.96 1.838 . . . . 0.0 108.407 177.445 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.983 HG21 HD13 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -68.28 -18.6 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 112.97 -1.923 . . . . 0.0 112.265 -177.543 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.14 -45.23 16.72 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.168 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.862 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -60.39 -32.33 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.467 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 1.053 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.98 -42.0 1.3 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.163 -1.38 . . . . 0.0 110.536 177.83 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.927 HD22 HD21 ' B' ' 15' ' ' LEU . 9.8 mt -83.12 -29.7 28.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.726 -179.674 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.444 ' N ' ' O ' ' A' ' 32' ' ' VAL . 8.5 mt-30 -87.67 -18.62 29.15 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.489 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 1.053 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -109.44 4.52 22.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.418 0.554 . . . . 0.0 112.412 179.687 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.585 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.9 t80 -79.85 145.61 32.65 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.661 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.477 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.729 -0.653 . . . . 0.0 112.245 179.48 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.83 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.908 0.385 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . 0.484 ' O ' ' HD3' ' B' ' 1' ' ' ARG . 99.2 m95 -69.26 174.84 4.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.697 179.896 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.536 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 tp -169.14 137.38 1.95 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -117.16 138.69 51.5 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.683 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.043 HD12 HD21 ' B' ' 7' ' ' LEU . 1.3 pp -161.81 173.63 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.222 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.518 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.7 t-105 -93.0 114.25 26.75 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.463 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 1.043 HD21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -128.97 123.78 33.34 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.561 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.868 ' O ' HD23 ' B' ' 12' ' ' LEU . 11.6 p -81.5 -174.24 4.85 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.839 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -63.3 -163.55 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.808 -178.827 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . 0.408 ' O ' ' HB ' ' B' ' 11' ' ' THR . 0.0 OUTLIER 35.37 41.75 0.09 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.447 0.699 . . . . 0.0 112.723 179.014 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.642 ' HA ' ' CB ' ' B' ' 14' ' ' ASP . 0.7 OUTLIER -178.38 -56.15 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.998 179.678 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.881 HD22 ' HB2' ' A' ' 1' ' ' ARG . 1.0 OUTLIER -61.97 -30.38 70.89 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.445 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -95.46 -35.87 11.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.06 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.642 ' CB ' ' HA ' ' B' ' 11' ' ' THR . 6.6 t70 -44.69 -31.17 1.09 Allowed 'General case' 0 C--N 1.343 0.306 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.217 179.779 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.927 HD21 HD22 ' A' ' 34' ' ' LEU . 44.2 mt -67.64 14.69 0.05 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.496 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -83.23 -42.11 17.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.262 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.487 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 5.1 mtpm? -91.37 -21.62 20.9 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.368 179.009 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.872 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 2.6 mtm -83.98 -26.51 29.14 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.586 -179.731 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.744 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.22 -69.51 0.76 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.637 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -53.16 -67.82 0.22 Allowed 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.35 -33.71 14.13 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.365 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.562 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.3 mm-40 -85.5 -11.2 54.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.16 179.703 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.94 -9.1 78.42 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.624 -178.219 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.744 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 60.3 mt -75.76 177.77 6.63 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 121.543 0.687 . . . . 0.0 111.52 179.963 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.1 p -124.51 170.41 10.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.98 -40.59 6.56 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.62 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 3.8 p -85.83 -51.37 6.45 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -179.802 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.579 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.9 mm-40 -64.04 -4.18 3.24 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 121.388 -0.125 . . . . 0.0 111.292 179.579 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.872 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 3.5 tpt -94.33 -50.3 5.31 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 177.666 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.874 HG22 HD11 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -73.59 -36.66 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.911 0 CA-C-N 113.311 -1.768 . . . . 0.0 112.677 -178.426 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.428 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.62 -48.94 65.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.941 0.877 . . . . 0.0 109.441 177.344 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.579 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -59.92 -36.79 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.376 -179.851 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.944 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -50.74 -32.47 19.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.105 179.209 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.867 HD22 HD21 ' A' ' 15' ' ' LEU . 13.4 mt -90.64 -28.92 18.07 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.557 -177.634 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -68.92 -19.66 64.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.49 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -102.84 25.71 8.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.863 0.363 . . . . 0.0 110.382 177.101 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.68 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 1.4 t80 -103.8 144.49 31.42 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.667 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.68 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 2.1 mppt? . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.191 178.159 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.75 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.8 mpt_? . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 120.921 0.391 . . . . 0.0 111.661 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -100.19 121.19 41.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.48 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.507 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -132.44 137.07 47.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.49 -178.63 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.935 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -119.34 128.39 54.07 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.553 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.92 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -151.29 -178.86 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.231 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.423 ' O ' HD13 ' A' ' 7' ' ' LEU . 76.2 t-105 -93.52 96.39 9.84 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -177.097 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.817 HD11 HG22 ' B' ' 30' ' ' ILE . 1.4 mm? -121.54 117.73 27.5 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 176.39 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.696 ' C ' HD23 ' A' ' 12' ' ' LEU . 50.7 p -65.84 165.93 12.04 Favored 'General case' 0 N--CA 1.427 -1.589 0 CA-C-O 122.21 1.005 . . . . 0.0 111.283 -178.336 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.466 ' CG ' ' HG3' ' A' ' 13' ' ' GLU . 5.8 t70 -60.65 -35.74 76.96 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 113.237 -1.801 . . . . 0.0 113.077 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -71.37 32.25 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.629 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.755 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -171.18 -50.26 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 122.881 0.472 . . . . 0.0 111.787 178.618 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.789 ' CD2' ' HD2' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -56.3 -29.83 61.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.836 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.466 ' HG3' ' CG ' ' A' ' 9' ' ' ASP . 3.0 mm-40 -88.28 -38.24 15.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.321 -1.309 . . . . 0.0 108.571 177.393 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.755 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 4.7 t70 -44.72 -24.45 0.2 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.214 178.158 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.94 HD21 HD13 ' B' ' 34' ' ' LEU . 50.1 mt -67.51 14.6 0.05 Allowed 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.325 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.8 mt-10 -87.01 -44.62 11.45 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.2 mttp -79.5 -22.77 43.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.067 178.966 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.986 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 5.0 mtm -90.25 -23.61 21.18 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.047 -179.167 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.748 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -102.3 -65.87 0.96 Allowed 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.4 mtp85 . . . . . 0 N--CA 1.468 0.459 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.013 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.748 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 68.2 mt . . . . . 0 N--CA 1.453 -0.31 0 CA-C-O 121.508 0.671 . . . . 0.0 111.301 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -124.91 172.31 9.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.916 178.755 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.475 ' HB3' ' CG2' ' B' ' 5' ' ' ILE . 0.6 OUTLIER -46.15 -39.8 10.14 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.139 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.689 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 1.3 p -87.87 -50.18 6.61 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.445 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.4 mt-10 -63.58 -6.32 5.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.624 0.249 . . . . 0.0 110.484 178.96 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.986 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.4 tpt -89.73 -50.01 6.31 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-O 122.562 1.173 . . . . 0.0 107.983 178.075 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.084 HG22 HD11 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -73.77 -38.57 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.064 0 CA-C-N 113.202 -1.817 . . . . 0.0 112.444 -178.004 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -61.88 -46.76 88.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 122.091 0.948 . . . . 0.0 108.56 176.684 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.445 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.85 -41.22 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.219 -179.979 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.69 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -53.36 -34.79 58.98 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.656 178.915 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.862 HD13 HD21 ' B' ' 15' ' ' LEU . 10.3 mt -79.38 -29.07 41.91 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.256 -178.874 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -79.16 -16.98 55.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.785 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.9 m80 -102.95 2.61 35.34 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.594 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.663 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 1.9 t80 -67.4 -168.95 0.09 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.543 0.337 . . . . 0.0 111.078 179.718 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.455 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 C-N-CA 125.866 1.666 . . . . 0.0 112.818 -178.535 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.789 ' HD2' ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.819 0.343 . . . . 0.0 111.145 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.84 130.57 41.37 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.057 0.456 . . . . 0.0 110.941 -179.266 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -130.57 142.93 50.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.542 -178.859 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.935 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -127.87 132.84 49.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.739 179.108 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.063 HD12 HG21 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -150.27 -175.28 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.465 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.798 ' O ' HD13 ' B' ' 7' ' ' LEU . 76.6 t-105 -103.79 92.32 4.37 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -177.252 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 1.084 HD11 HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -128.45 112.9 14.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.412 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.75 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.2 OUTLIER -86.35 -164.99 1.13 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.764 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -45.27 -66.46 0.4 Allowed 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.067 -1.424 . . . . 0.0 113.691 -178.044 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -47.88 -22.07 0.51 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.275 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.644 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 28.9 p -101.26 -35.5 9.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.433 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' B' ' 8' ' ' SER . 55.1 mt -69.7 -41.06 75.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 178.475 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -60.91 -41.86 96.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.84 -1.527 . . . . 0.0 107.442 175.858 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.644 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.3 OUTLIER -51.83 -39.28 58.55 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.172 178.367 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.862 HD21 HD13 ' A' ' 34' ' ' LEU . 27.0 mt -78.38 29.91 0.18 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.412 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -104.47 -59.51 1.73 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.435 ' HG3' ' N ' ' B' ' 18' ' ' MET . 6.7 pttm -71.32 -21.73 62.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.72 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.871 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 7.5 mtm -91.17 -18.45 24.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.193 -179.866 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.734 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -103.19 -67.15 0.9 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.909 179.101 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -59.98 -66.29 0.54 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 120.914 0.388 . . . . 0.0 112.034 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.7 -33.25 15.39 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 18' ' ' MET . 6.8 mm-40 -85.87 -10.83 54.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.351 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.58 -10.75 73.64 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.9 -178.681 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.734 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 57.4 mt -71.99 177.26 4.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.606 0.717 . . . . 0.0 111.561 179.779 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 37.5 p -123.44 168.04 13.06 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.46 178.784 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.19 -40.82 5.34 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.357 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.861 ' HA ' HD12 ' A' ' 5' ' ' ILE . 2.2 p -83.68 -51.49 7.22 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.402 ' O ' HG12 ' B' ' 32' ' ' VAL . 2.9 mm-40 -63.64 -7.21 6.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.654 0.264 . . . . 0.0 110.816 178.878 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.871 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.7 tpt -89.18 -49.47 6.72 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 177.781 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.92 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -72.35 -27.95 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.288 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.696 -178.335 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.444 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.83 -52.36 37.75 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.627 0.727 . . . . 0.0 109.785 177.204 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.444 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 10.0 p -63.88 -32.65 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.819 -177.392 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.885 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -49.36 -32.05 10.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.892 177.437 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.94 HD13 HD21 ' A' ' 15' ' ' LEU . 14.4 mt -88.72 -26.64 21.68 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.159 -177.121 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.84 -27.51 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -177.614 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.885 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 6.4 p-80 -89.43 -33.47 16.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.963 0.801 . . . . 0.0 111.022 177.627 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.433 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 20.4 t80 -35.89 144.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.998 0.519 . . . . 0.0 111.877 -179.533 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt . . . . . 0 C--O 1.25 1.101 0 C-N-CA 123.611 0.765 . . . . 0.0 112.178 178.938 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.584 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 111.652 0.242 . . . . 0.0 111.652 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -71.54 123.57 22.75 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.713 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.504 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.2 tp -122.1 132.66 54.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.655 -178.589 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.969 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -117.7 117.92 30.66 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.126 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.888 HD11 HG21 ' B' ' 30' ' ' ILE . 5.5 pt -143.26 176.42 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.827 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.507 ' O ' HD13 ' A' ' 7' ' ' LEU . 74.4 t-105 -98.74 105.25 17.37 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -177.025 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.737 HD11 HG22 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -128.7 123.63 33.57 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.781 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.974 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -86.29 -163.48 0.89 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.171 -179.555 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.708 ' O ' HG22 ' A' ' 11' ' ' THR . 3.1 t70 -63.61 -165.14 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.381 -177.949 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.541 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.7 tt0 36.83 40.68 0.15 Allowed 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.543 0.737 . . . . 0.0 112.761 179.307 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.708 HG22 ' O ' ' A' ' 9' ' ' ASP . 11.2 t 177.39 -51.21 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.274 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.974 HD23 ' C ' ' A' ' 8' ' ' SER . 0.5 OUTLIER -68.44 -30.19 69.01 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.516 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.78 -40.16 12.66 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 113.745 -1.57 . . . . 0.0 107.706 177.577 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.685 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -44.17 -28.88 0.55 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.803 179.266 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.919 HD21 HD13 ' B' ' 34' ' ' LEU . 34.9 mt -69.2 20.21 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.467 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -97.18 -44.32 6.99 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.674 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 21.7 mtpp -87.73 -26.86 22.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.797 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 7.6 mtm -82.39 -14.5 55.11 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.959 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.774 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -100.63 -64.66 1.02 Allowed 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.525 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 . . . . . 0 CA--C 1.516 -0.327 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -178.838 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.774 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 121.099 0.475 . . . . 0.0 111.587 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.452 ' N ' HD23 ' A' ' 24' ' ' LEU . 84.5 p -100.19 165.54 11.44 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.414 -178.791 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 1.1 mmmm -48.23 -35.72 12.46 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.471 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.5 m -78.55 -58.33 3.3 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 122.239 0.216 . . . . 0.0 110.781 179.88 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.478 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.0 mm-40 -57.77 -16.84 12.52 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 178.431 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.797 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 0.8 OUTLIER -75.42 -50.33 16.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 122.621 1.2 . . . . 0.0 108.115 177.86 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.79 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -70.63 -34.17 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.122 0 CA-C-N 113.007 -1.906 . . . . 0.0 113.069 -177.697 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.456 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.79 -49.03 67.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.046 0.927 . . . . 0.0 108.794 177.023 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.478 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -54.93 -42.1 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.626 -179.702 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.774 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -46.75 -36.15 6.93 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.188 179.367 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 1.097 HD13 ' CD1' ' B' ' 15' ' ' LEU . 10.5 mt -77.56 -37.1 51.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.009 -178.081 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.423 HE22 ' CG ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -71.22 -17.05 62.52 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.484 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -107.02 27.23 9.21 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 177.142 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.745 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 9.8 t80 -117.08 146.7 42.95 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.667 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.636 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.1 0 C-N-CA 123.74 0.816 . . . . 0.0 112.117 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.922 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.159 0.504 . . . . 0.0 111.944 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -101.87 117.48 34.94 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.953 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.545 HD21 HD11 ' B' ' 5' ' ' ILE . 15.8 tp -108.12 132.88 53.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.531 -177.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.969 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -126.91 119.36 26.55 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.212 178.442 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.7 HD12 HD21 ' B' ' 7' ' ' LEU . 1.0 OUTLIER -152.65 -178.23 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.363 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.573 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.1 t-105 -93.49 91.48 7.15 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -177.726 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.79 HD11 HG22 ' A' ' 30' ' ' ILE . 2.1 mm? -128.75 104.14 7.46 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.429 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.584 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 8.8 t -69.66 -135.71 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.891 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -90.23 -38.76 13.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -177.631 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . 0.577 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 1.4 mt-30 -73.59 41.83 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.087 0.47 . . . . 0.0 111.717 -179.181 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.736 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 1.1 t -165.27 -37.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 178.826 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.416 ' CD2' HD22 ' A' ' 3' ' ' LEU . 15.4 mt -79.87 -42.87 23.33 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.112 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.35 -30.25 22.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.619 177.576 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.736 ' HB2' ' N ' ' B' ' 11' ' ' THR . 5.6 t70 -41.99 -19.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.002 -1.454 . . . . 0.0 113.333 -179.052 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.097 ' CD1' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -137.14 56.02 1.8 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 179.272 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.579 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 4.1 mt-10 -56.57 -25.27 51.84 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.929 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.695 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 9.1 mttp -84.68 -45.07 12.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.948 179.399 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 1.051 ' HE3' ' HG ' ' B' ' 15' ' ' LEU . 20.3 mtm -59.09 -25.89 64.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.796 0.331 . . . . 0.0 110.591 179.614 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.7 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -100.91 -64.82 1.01 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.352 179.581 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.579 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 2.9 mtp85 -67.06 -65.14 0.72 Allowed 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.112 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . 0.695 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.96 -34.33 20.51 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.512 -179.859 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.504 ' HB2' ' O ' ' B' ' 18' ' ' MET . 8.8 mm-40 -82.43 -14.53 54.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.017 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.9 -5.98 83.06 Favored Glycine 0 C--N 1.339 0.707 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.702 -178.546 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.778 HD12 ' O ' ' B' ' 18' ' ' MET . 76.6 mt -71.8 177.57 4.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 111.681 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . 0.485 ' O ' ' HB3' ' B' ' 29' ' ' MET . 25.1 p -119.0 169.33 9.99 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.261 178.418 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.41 -37.66 17.61 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.492 ' HA ' HD12 ' A' ' 5' ' ' ILE . 6.0 p -87.02 -49.76 7.11 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.566 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.459 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.4 mm-40 -61.12 -11.62 9.45 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 121.046 -0.262 . . . . 0.0 111.019 179.686 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.902 ' HG2' HD21 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -85.28 -43.05 14.08 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 176.748 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.888 HG21 HD11 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -78.99 -24.59 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-N 113.616 -1.629 . . . . 0.0 113.789 -176.942 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.523 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -66.26 -53.92 31.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.658 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.523 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 15.0 p -64.29 -32.6 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.673 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.333 -177.69 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.906 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -52.3 -27.97 17.26 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.651 177.195 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.919 HD13 HD21 ' A' ' 15' ' ' LEU . 13.4 mt -90.31 -27.15 19.61 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.416 -178.374 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -69.18 -37.25 78.06 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -178.049 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.906 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 4.5 p-80 -81.77 -41.45 21.16 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 118.952 0.796 . . . . 0.0 110.772 178.309 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 28.3 t80 -48.48 150.24 1.4 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.907 -179.42 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 117.947 -1.025 . . . . 0.0 112.3 178.172 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.713 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.096 0.474 . . . . 0.0 111.914 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -110.36 117.21 33.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 177.353 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -127.8 140.93 51.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.725 -177.883 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.923 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -120.73 129.87 53.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.414 178.624 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.612 ' CD1' HG21 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -150.85 -176.94 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.5 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.614 ' C ' HD22 ' A' ' 7' ' ' LEU . 70.9 t-105 -92.69 94.79 9.19 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.591 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.91 HD11 HG22 ' B' ' 30' ' ' ILE . 1.8 mm? -130.36 105.44 7.89 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.3 177.76 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 51.8 p -67.7 -139.18 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.582 0.229 . . . . 0.0 110.941 -178.855 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -99.0 -142.64 0.32 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 119.558 -0.258 . . . . 0.0 111.386 -179.191 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.412 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.0 OUTLIER 33.38 42.11 0.04 OUTLIER 'General case' 0 C--N 1.346 0.445 0 C-N-CA 123.455 0.702 . . . . 0.0 112.67 179.401 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.678 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -176.34 -49.9 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.989 179.488 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.847 HD22 HD22 ' B' ' 3' ' ' LEU . 47.7 mt -71.22 -39.8 71.49 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 176.016 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -40.44 65.0 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 113.134 -1.848 . . . . 0.0 107.04 176.088 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.678 ' CB ' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -49.39 -27.46 4.09 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 113.497 -1.683 . . . . 0.0 110.753 179.108 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.025 HD21 HD13 ' B' ' 34' ' ' LEU . 74.3 mt -63.02 4.52 0.18 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -60.73 -59.04 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 179.49 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.4 pttp -85.76 -9.02 57.76 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.392 178.88 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.574 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 10.7 mtp -88.37 -23.46 23.37 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.944 179.48 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -101.35 -60.62 1.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.567 -179.796 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.6 mtp-105 . . . . . 0 CA--C 1.515 -0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 111.549 -179.716 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.818 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.612 0 CA-C-O 121.153 0.501 . . . . 0.0 111.748 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.491 ' N ' HD23 ' A' ' 24' ' ' LEU . 0.7 OUTLIER -110.69 166.88 10.66 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.865 -178.696 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -38.11 -43.29 0.73 Allowed 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -179.271 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.623 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 4.4 m -78.45 -53.39 7.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.733 0.242 . . . . 0.0 111.295 -179.27 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.609 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mt-10 -64.37 -15.2 60.0 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 110.023 178.605 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.697 ' HB2' HD21 ' A' ' 24' ' ' LEU . 2.5 tpt -77.09 -46.93 21.92 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.245 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.098 HG21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.0 -25.92 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.788 0 CA-C-N 112.834 -1.985 . . . . 0.0 112.716 -178.586 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.562 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.44 -51.25 58.87 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.674 0.749 . . . . 0.0 109.241 177.395 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.562 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 12.3 p -66.97 -31.69 54.59 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.679 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.56 -177.866 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.742 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -44.9 -34.07 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.32 177.406 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.808 HD13 HD21 ' B' ' 15' ' ' LEU . 8.8 mt -95.75 -24.92 16.28 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -177.769 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -69.69 -39.76 76.76 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.858 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.742 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -64.12 -34.73 78.71 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.237 0.926 . . . . 0.0 110.225 178.247 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.651 ' CD1' ' N ' ' A' ' 38' ' ' LYS . 0.9 OUTLIER -48.83 141.71 7.16 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.076 -179.629 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.651 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 177.193 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 120.899 0.38 . . . . 0.0 111.571 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -79.42 133.79 36.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.859 179.603 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.847 HD22 HD22 ' A' ' 12' ' ' LEU . 2.2 tp -133.41 144.85 49.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.516 -178.647 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.923 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.3 OUTLIER -128.92 130.3 46.61 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.71 179.077 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 1.098 HD12 HG21 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -150.34 -173.86 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.579 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.623 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 67.0 t-105 -97.91 101.6 13.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.485 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.902 HD11 ' CG2' ' A' ' 30' ' ' ILE . 1.6 mm? -128.27 107.0 9.41 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.499 178.113 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.713 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 11.1 p -79.99 -172.95 3.66 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 121.508 0.671 . . . . 0.0 112.103 -178.492 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -48.96 -58.07 5.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.967 -179.55 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -50.48 -30.79 13.59 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.021 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.663 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 44.2 p -87.57 -34.7 18.47 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.776 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' B' ' 8' ' ' SER . 50.2 mt -68.58 -39.82 80.8 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 178.394 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.11 -41.52 94.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.53 -1.668 . . . . 0.0 108.365 176.496 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.663 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.3 OUTLIER -52.57 -46.44 66.87 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.086 179.036 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.808 HD21 HD13 ' A' ' 34' ' ' LEU . 23.9 mt -77.34 32.31 0.15 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.97 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -105.64 -55.7 2.29 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.226 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -82.13 -24.77 34.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.465 179.214 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.706 ' HE2' HD23 ' B' ' 15' ' ' LEU . 8.0 mtm -85.08 -14.49 47.04 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.688 0.28 . . . . 0.0 110.451 179.294 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.841 ' HA ' HD21 ' B' ' 24' ' ' LEU . . . -99.92 -65.51 0.96 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.026 -179.891 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 22.3 mtp85 -58.56 -63.54 1.25 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.044 0.449 . . . . 0.0 111.502 -179.146 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.46 -34.75 17.59 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.549 179.381 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' B' ' 18' ' ' MET . 3.2 mm-40 -73.22 -28.64 62.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.145 178.907 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.65 -15.67 37.82 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.332 179.663 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.841 HD21 ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -90.64 -172.51 3.42 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.197 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.1 p -114.28 170.73 8.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.699 -179.883 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 3.1 mttm -44.64 -39.77 5.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.428 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . 0.62 ' O ' HD11 ' A' ' 7' ' ' LEU . 13.2 m -71.94 -62.03 1.57 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.483 0.182 . . . . 0.0 110.906 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.669 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.6 mm-40 -57.95 -17.05 14.54 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.132 179.353 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.743 ' HE3' ' CG2' ' B' ' 32' ' ' VAL . 1.3 tpt -78.07 -45.78 22.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 123.601 1.667 . . . . 0.0 107.565 177.466 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.91 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -67.73 -18.76 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.789 0 CA-C-N 112.845 -1.98 . . . . 0.0 112.21 -177.987 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.435 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -81.71 -44.96 16.37 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.67 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.807 ' HB ' ' CD2' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -60.41 -32.28 50.73 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.659 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 1.02 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -35.74 -40.04 0.17 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 113.656 -1.611 . . . . 0.0 110.967 178.325 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 15' ' ' LEU . 4.0 mt -94.72 -28.38 15.34 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.259 -179.216 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' B' ' 32' ' ' VAL . 9.9 mt-30 -83.14 -30.13 28.1 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -179.375 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 1.02 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -94.3 19.43 9.48 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 117.909 0.322 . . . . 0.0 111.654 179.446 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.731 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -56.48 129.51 41.04 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -179.721 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.701 ' N ' ' HD1' ' B' ' 37' ' ' TYR . 1.4 mmmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 117.824 -1.084 . . . . 0.0 111.38 176.277 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 111.471 0.175 . . . . 0.0 111.471 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -80.58 113.13 18.56 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.465 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.417 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -122.95 141.33 52.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.058 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.63 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -116.96 128.73 55.49 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.975 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.86 HG13 HD21 ' A' ' 7' ' ' LEU . 1.9 pt -151.57 178.51 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.095 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -91.07 89.79 7.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -177.481 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.86 HD21 HG13 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -120.36 102.54 8.54 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.86 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.2 p -67.62 -140.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -177.061 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.406 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.6 t70 -95.28 -38.86 10.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.507 -178.011 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -72.55 39.45 0.08 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.946 0.498 . . . . 0.0 112.039 -179.153 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.841 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -163.59 -43.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.18 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 7' ' ' LEU . 56.6 mt -68.12 -41.26 81.97 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.214 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.05 -38.46 90.91 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 113.416 -1.72 . . . . 0.0 107.917 176.07 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.841 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -51.78 -42.72 62.63 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.996 178.331 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 1.07 HD21 HD13 ' B' ' 34' ' ' LEU . 50.3 mt -73.31 -12.7 60.93 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.744 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.83 -42.31 71.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.62 0.247 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -92.93 -20.94 20.12 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.717 179.325 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.916 ' HE2' HD23 ' A' ' 15' ' ' LEU . 30.9 mtm -87.21 -61.31 1.75 Allowed 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -179.3 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.618 ' HA ' ' HB2' ' A' ' 29' ' ' MET . . . -25.18 -34.5 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 114.214 1.191 . . . . 0.0 114.214 -178.48 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 18' ' ' MET . 31.3 mmm-85 . . . . . 0 C--N 1.315 -0.892 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.797 179.643 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.896 ' CD2' ' HB3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.556 1.195 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 . . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.697 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 1.9 t 131.68 163.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 127.707 2.403 . . . . 0.0 109.495 177.904 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 26' ' ' LYS . 5.4 mtpt -69.24 -48.18 62.64 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.577 179.824 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.412 ' CB ' ' H ' ' B' ' 6' ' ' TRP . 9.6 m -77.95 -30.77 50.56 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.261 178.101 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.896 ' HB3' ' CD2' ' A' ' 24' ' ' LEU . 2.6 mm-40 -73.31 -28.47 62.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.743 179.091 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.974 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.4 tpt -67.87 -46.08 72.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 123.759 1.742 . . . . 0.0 107.896 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.083 HG22 HD11 ' B' ' 7' ' ' LEU . 0.4 OUTLIER -65.75 -18.45 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.037 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.845 -179.371 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -50.33 11.35 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.144 177.084 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.848 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -55.4 -34.47 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 178.562 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 1.007 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -35.56 -46.56 0.41 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.558 -1.655 . . . . 0.0 111.556 178.056 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.998 HD13 ' CD2' ' B' ' 15' ' ' LEU . 6.2 mt -83.5 -32.82 25.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.868 -179.092 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -81.05 -11.74 59.46 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 179.478 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 1.007 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -123.29 -4.93 8.34 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -179.529 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.615 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.7 OUTLIER -62.6 142.17 58.15 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.847 0.459 . . . . 0.0 110.52 179.88 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.863 -1.065 . . . . 0.0 112.262 178.763 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.55 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -73.81 127.3 32.45 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.048 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.1 tp -134.48 137.82 44.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.629 -178.869 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.63 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -111.07 128.54 55.91 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.804 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.995 ' CD1' HG21 ' A' ' 30' ' ' ILE . 4.0 pt -150.62 176.19 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.446 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.577 ' C ' HD22 ' B' ' 7' ' ' LEU . 74.5 t-105 -94.58 104.12 16.06 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.612 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 1.083 HD11 HG22 ' A' ' 30' ' ' ILE . 1.3 mm? -124.08 115.48 21.24 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 176.976 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 28.0 p -73.86 -135.91 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.637 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 12.9 t70 -96.49 -39.79 9.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -177.755 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -72.29 41.31 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.72 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.645 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 4.7 t -160.57 -44.49 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.307 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.415 HD21 ' HB2' ' B' ' 7' ' ' LEU . 17.6 mt -73.79 -41.9 61.74 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.677 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' B' ' 9' ' ' ASP . 1.9 mt-10 -76.32 -37.98 56.63 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 113.555 -1.657 . . . . 0.0 108.366 176.472 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.645 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -48.8 -32.14 8.21 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.227 178.304 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.998 ' CD2' HD13 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -82.13 32.89 0.39 Allowed 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 124.654 1.182 . . . . 0.0 112.923 179.906 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.557 ' HG2' ' N ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -81.84 -41.92 20.37 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.995 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . 0.557 ' N ' ' HG2' ' B' ' 16' ' ' GLU . 24.0 mtpp -115.59 24.07 11.85 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.626 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.7 ' SD ' HD22 ' B' ' 15' ' ' LEU . 35.6 mtp -110.83 -75.53 0.62 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.397 0.141 . . . . 0.0 111.356 -179.831 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.975 ' HB2' ' CD1' ' B' ' 15' ' ' LEU . . . -25.46 -32.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.865 1.666 . . . . 0.0 114.131 -177.913 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' B' ' 18' ' ' MET . 0.0 OUTLIER -62.5 -141.46 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.476 -0.489 . . . . 0.0 109.699 177.944 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . 0.468 ' N ' ' CG ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -43.43 -21.94 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.577 -0.702 . . . . 0.0 112.279 179.043 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' B' ' 20' ' ' ARG . 19.5 mm-40 -104.42 -12.93 16.28 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -177.769 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . 0.731 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -137.71 12.26 3.69 Favored Glycine 0 CA--C 1.501 -0.79 0 C-N-CA 116.804 -2.617 . . . . 0.0 116.962 -175.713 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' B' ' 19' ' ' ALA . 1.1 mp 53.55 -161.97 0.12 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 119.723 1.762 . . . . 0.0 112.622 177.038 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -64.14 158.85 21.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.438 178.895 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.48 -43.14 11.37 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 117.624 0.193 . . . . 0.0 111.509 -179.608 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -82.69 -50.28 8.89 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.883 -0.144 . . . . 0.0 111.078 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . 0.48 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.2 mm-40 -54.07 -30.12 46.91 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.799 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 0.867 ' SD ' HD21 ' B' ' 15' ' ' LEU . 3.5 tpt -60.39 -47.58 85.45 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 122.82 1.295 . . . . 0.0 109.821 177.603 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.737 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -79.28 -29.47 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.43 0 CA-C-N 112.407 -2.179 . . . . 0.0 114.056 -175.341 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -70.58 -48.16 56.64 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.297 1.046 . . . . 0.0 108.931 177.079 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 2.1 t -58.96 -47.07 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.469 -179.304 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.873 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -45.18 -34.81 2.91 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.804 179.686 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 1.07 HD13 HD21 ' A' ' 15' ' ' LEU . 13.6 mt -83.78 -30.46 26.58 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.398 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -80.36 -9.19 59.74 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.951 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -120.43 25.86 9.54 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 120.71 0.29 . . . . 0.0 111.153 177.961 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.596 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 22.1 t80 -132.96 163.55 28.94 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.744 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.595 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.5 tppt? . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.137 178.757 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.211 0.053 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -79.69 120.17 23.63 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.998 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.479 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.7 mm? -131.48 153.63 49.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.494 -178.995 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.894 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -126.65 127.56 45.37 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.329 178.829 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.838 HD11 HG21 ' B' ' 30' ' ' ILE . 2.7 pt -145.32 176.49 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.446 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.483 ' C ' HD22 ' A' ' 7' ' ' LEU . 73.3 t-105 -96.2 95.06 7.87 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.156 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.799 HD21 HD12 ' A' ' 5' ' ' ILE . 1.3 mm? -124.9 108.23 11.69 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.298 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.0 p -72.37 -136.79 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.535 0.207 . . . . 0.0 111.07 -178.867 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.681 ' O ' HG22 ' A' ' 11' ' ' THR . 1.7 t70 -88.14 -156.46 0.36 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 119.798 -0.144 . . . . 0.0 110.932 -179.535 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.15 44.1 0.09 Allowed 'General case' 0 C--N 1.346 0.413 0 C-N-CA 123.229 0.611 . . . . 0.0 112.089 179.24 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.697 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 7.8 t -172.65 -46.45 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.714 179.673 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.741 HD21 ' HB2' ' A' ' 7' ' ' LEU . 34.5 mt -73.57 -42.58 61.44 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 175.774 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.96 -39.61 83.34 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 113.323 -1.762 . . . . 0.0 107.081 175.657 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.697 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.9 t70 -49.46 -30.69 8.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.015 -1.448 . . . . 0.0 110.415 178.581 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.988 HD21 HD13 ' B' ' 34' ' ' LEU . 45.6 mt -73.51 22.73 0.07 Allowed 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.703 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -83.85 -66.1 0.93 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 122.17 -0.332 . . . . 0.0 110.551 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.75 -15.22 60.3 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.712 179.528 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.792 ' CE ' HD23 ' A' ' 15' ' ' LEU . 15.7 mtm -87.1 -27.37 23.16 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.37 -179.861 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.82 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -102.13 -59.38 1.71 Allowed 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.354 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.513 -0.475 0 CA-C-O 120.902 0.382 . . . . 0.0 111.601 -179.171 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.85 HD21 ' HB2' ' A' ' 29' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.539 0 CA-C-O 120.922 0.391 . . . . 0.0 111.9 . . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.657 ' N ' HD23 ' A' ' 24' ' ' LEU . 19.3 p -113.76 169.6 8.87 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.779 -178.655 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.533 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -37.48 -42.4 0.51 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -179.385 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.692 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 29.2 p -72.42 -62.46 1.43 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.363 0.265 . . . . 0.0 111.586 -179.644 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mm-40 -58.56 -13.16 5.04 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.594 179.074 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.85 ' HB2' HD21 ' A' ' 24' ' ' LEU . 2.6 tpt -82.39 -48.25 11.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 122.736 1.255 . . . . 0.0 108.302 178.311 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.702 HD13 HD21 ' B' ' 34' ' ' LEU . 0.6 OUTLIER -74.51 -36.24 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.106 0 CA-C-N 112.806 -1.997 . . . . 0.0 112.916 -177.696 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.45 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -64.18 -47.04 81.37 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.136 0.969 . . . . 0.0 108.75 176.864 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.96 -42.3 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 113.239 -1.801 . . . . 0.0 111.422 -179.584 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.746 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.82 -42.27 58.26 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.443 179.622 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.877 HD13 HD23 ' B' ' 15' ' ' LEU . 9.4 mt -73.76 -34.32 64.65 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.617 -178.037 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -74.46 -13.57 60.72 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -107.85 -40.1 5.36 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 177.983 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.623 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.4 t80 -29.33 133.02 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.038 0.535 . . . . 0.0 111.963 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.058 178.147 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 1' ' ' ARG . . . . . 0.475 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 . . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -78.97 122.37 26.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 178.963 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 3' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -130.57 152.5 49.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.334 -179.271 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 4' ' ' CYS . . . . . 0.894 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -125.67 128.31 47.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.532 178.956 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.492 ' CD1' HG21 ' A' ' 30' ' ' ILE . 2.3 pp -151.21 169.45 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-O 121.037 0.446 . . . . 0.0 112.118 -178.801 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.692 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 68.4 t-105 -81.19 90.51 6.08 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.74 0.781 . . . . 0.0 111.29 -179.594 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.637 ' HG ' HG23 ' B' ' 11' ' ' THR . 12.7 tp -107.17 95.39 5.68 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 178.537 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 8' ' ' SER . . . . . 0.57 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 6.0 p -81.34 -157.94 0.19 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.96 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -66.08 -41.57 90.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.913 -178.125 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -74.33 42.28 0.15 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.147 0.499 . . . . 0.0 111.346 -179.54 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 11' ' ' THR . . . . . 0.722 ' OG1' HD12 ' A' ' 34' ' ' LEU . 9.5 t -167.83 -43.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -179.822 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' B' ' 8' ' ' SER . 28.1 mt -69.9 -41.65 74.41 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.26 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' B' ' 16' ' ' GLU . 2.7 mt-10 -73.97 -41.35 62.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.37 -1.741 . . . . 0.0 108.187 176.582 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 14' ' ' ASP . . . . . 0.639 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -49.07 -27.31 3.25 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.091 178.519 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 1.033 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.57 40.56 0.59 Allowed 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 124.134 0.974 . . . . 0.0 112.385 179.883 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' B' ' 13' ' ' GLU . 7.1 mt-10 -74.59 -66.82 0.69 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.475 179.823 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -107.89 33.39 4.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.231 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 18' ' ' MET . . . . . 0.643 ' HB2' HD13 ' B' ' 15' ' ' LEU . 3.2 mtm -105.36 -84.52 0.5 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 122.322 -0.236 . . . . 0.0 110.684 179.679 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.758 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -48.49 -49.27 36.45 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.26 0.624 . . . . 0.0 111.693 179.873 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -61.33 -65.4 0.7 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.156 0.503 . . . . 0.0 111.26 -179.639 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -32.52 27.79 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.28 179.368 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 22' ' ' GLU . . . . . 0.527 ' HB2' ' O ' ' B' ' 18' ' ' MET . 18.5 mm-40 -91.22 -6.8 52.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.22 4.45 68.54 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.295 -0.955 . . . . 0.0 111.666 -178.03 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 24' ' ' LEU . . . . . 0.758 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.1 mt -78.92 169.48 18.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.501 0.667 . . . . 0.0 111.174 179.911 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 92.5 p -112.24 161.06 17.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.477 178.036 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.38 -37.14 0.96 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.48 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.5 m -83.26 -58.12 2.97 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.644 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -59.09 -13.85 8.2 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.496 178.944 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 29' ' ' MET . . . . . 1.033 ' SD ' HD11 ' B' ' 15' ' ' LEU . 3.3 tpt -80.76 -47.17 14.3 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 122.679 1.228 . . . . 0.0 108.494 178.059 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.838 HG21 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -75.94 -28.97 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.206 0 CA-C-N 112.794 -2.003 . . . . 0.0 113.219 -177.319 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.456 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -68.2 -48.55 64.9 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 122.329 1.062 . . . . 0.0 108.668 177.105 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' B' B ' 32' ' ' VAL . . . . . 0.408 ' N ' HD22 ' B' ' 31' ' ' ASN . 2.2 t -56.97 -48.28 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.577 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.794 -179.533 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 33' ' ' ALA . . . . . 0.762 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -47.76 -38.49 15.61 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.49 179.051 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.988 HD13 HD21 ' A' ' 15' ' ' LEU . 11.6 mt -74.67 -31.07 61.81 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.957 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -82.69 -13.82 55.7 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.111 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -124.78 21.66 8.3 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.786 0.327 . . . . 0.0 111.4 177.889 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.558 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 0.6 OUTLIER -81.1 131.79 35.32 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.66 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.458 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.121 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 178.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.991 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 120.982 0.42 . . . . 0.0 111.968 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -96.0 118.99 33.7 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 4.5 tp -118.54 134.84 54.78 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.228 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.762 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -124.46 127.57 47.69 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.085 178.535 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.821 ' CD1' HG21 ' B' ' 30' ' ' ILE . 1.1 pt -152.91 -176.51 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.749 ' O ' HD13 ' A' ' 7' ' ' LEU . 71.4 t-105 -97.03 93.15 6.42 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -177.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.902 HD11 HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -128.04 109.34 11.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 177.392 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.749 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 9.1 p -79.13 -176.29 5.05 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -176.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -43.39 -59.12 2.25 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 113.769 -1.559 . . . . 0.0 112.992 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -47.43 -26.25 1.29 Allowed 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.625 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 21.9 p -101.25 -29.41 12.1 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 8' ' ' SER . 43.6 mt -73.54 -40.68 63.79 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 178.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.99 -40.71 94.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 113.68 -1.6 . . . . 0.0 107.551 175.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.625 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -52.8 -48.22 67.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.282 -1.326 . . . . 0.0 109.282 178.131 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.95 HD21 HD13 ' B' ' 34' ' ' LEU . 15.6 mt -71.61 9.92 0.76 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.473 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -102.53 -48.62 4.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.561 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.473 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 30.3 mttm -72.25 -40.8 67.43 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.017 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.708 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 43.4 mtm -68.97 -63.81 0.99 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.714 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.651 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -47.46 -49.48 25.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.745 0.418 . . . . 0.0 111.676 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.406 ' HD3' ' O ' ' A' ' 16' ' ' GLU . 15.9 mtp85 -58.26 -67.58 0.34 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.013 0.435 . . . . 0.0 111.627 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -30.84 22.76 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.153 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 18' ' ' MET . 20.2 mm-40 -88.36 -8.6 54.8 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.358 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.2 7.16 76.73 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 120.454 -0.879 . . . . 0.0 111.376 -177.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.651 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 95.5 mt -85.66 169.3 13.6 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.632 0.73 . . . . 0.0 111.561 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 m -114.01 166.05 11.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.335 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.9 -40.1 1.3 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.625 ' HA ' HD12 ' B' ' 5' ' ' ILE . 1.5 m -84.13 -54.2 4.99 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 111.532 0.197 . . . . 0.0 111.532 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.54 ' HB3' HD22 ' A' ' 24' ' ' LEU . 2.3 mm-40 -61.69 -10.74 9.31 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 120.722 0.296 . . . . 0.0 111.063 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.889 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.6 tpt -83.59 -47.32 11.41 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.69 1.233 . . . . 0.0 107.719 177.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.027 HG21 HD11 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -74.5 -31.53 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.152 0 CA-C-N 113.114 -1.857 . . . . 0.0 113.397 -178.167 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.431 ' OD1' HG21 ' B' ' 11' ' ' THR . 0.1 OUTLIER -65.54 -46.9 77.78 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.414 1.102 . . . . 0.0 108.555 177.201 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.402 ' N ' HD22 ' A' ' 31' ' ' ASN . 2.2 t -58.97 -47.37 90.03 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.595 0 CA-C-N 112.752 -2.022 . . . . 0.0 111.048 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.686 ' HA ' ' HB2' ' B' ' 37' ' ' TYR . . . -48.8 -37.69 19.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.29 179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.1 HD13 HD21 ' B' ' 15' ' ' LEU . 13.4 mt -77.98 -29.74 49.86 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.973 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -79.47 -16.14 56.59 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -125.44 14.98 8.26 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.499 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.4 OUTLIER -71.64 137.7 48.1 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.182 0 C-N-CA 123.383 0.673 . . . . 0.0 112.259 179.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.749 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.5 mpt_? . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 120.808 0.337 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -99.56 119.83 38.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.602 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.9 tp -130.95 135.03 47.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.412 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.762 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -117.88 128.84 55.22 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.027 HD11 HG21 ' A' ' 30' ' ' ILE . 4.6 pt -147.77 178.65 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.505 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.8 t-105 -99.75 103.14 14.77 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -176.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.77 HD11 HG22 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -126.23 118.97 26.25 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 177.084 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 1.013 ' C ' HD23 ' B' ' 12' ' ' LEU . 0.3 OUTLIER -84.06 -161.49 0.55 Allowed 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.857 -179.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . 0.673 ' O ' HG22 ' B' ' 11' ' ' THR . 2.6 p-10 -61.53 -168.6 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.359 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . 0.517 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.9 tt0 37.65 41.59 0.32 Allowed 'General case' 0 C--N 1.345 0.373 0 C-N-CA 123.456 0.702 . . . . 0.0 112.771 179.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.673 HG22 ' O ' ' B' ' 9' ' ' ASP . 11.5 t 177.32 -51.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.83 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 1.013 HD23 ' C ' ' B' ' 8' ' ' SER . 0.5 OUTLIER -67.49 -30.46 70.16 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 176.32 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.417 ' HG2' ' HG ' ' B' ' 12' ' ' LEU . 2.1 mm-40 -91.85 -38.64 12.21 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.424 177.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.655 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.1 t70 -44.39 -27.04 0.39 Allowed 'General case' 0 C--N 1.342 0.259 0 CA-C-N 114.438 -1.256 . . . . 0.0 111.045 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.1 HD21 HD13 ' A' ' 34' ' ' LEU . 33.2 mt -70.75 25.2 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 31.9 mt-10 -101.64 -55.75 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 31.7 mttp -75.18 -23.38 57.69 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.355 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.902 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 19.2 mtm -87.14 -22.28 25.44 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.102 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.761 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.72 -66.42 0.92 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.252 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.9 mtt-85 -58.13 -65.1 0.7 Allowed 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.978 0.418 . . . . 0.0 111.854 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.11 -33.26 18.15 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.275 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.514 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.6 mm-40 -87.39 -9.41 54.84 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.423 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.14 -8.26 77.36 Favored Glycine 0 C--N 1.339 0.696 0 C-N-CA 120.705 -0.759 . . . . 0.0 111.762 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.761 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 78.1 mt -72.14 174.89 6.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.541 0.686 . . . . 0.0 111.495 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.5 p -120.2 166.04 13.99 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.547 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.558 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -43.97 -39.45 4.07 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -179.362 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m -83.82 -53.08 5.87 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 121.996 0.119 . . . . 0.0 111.205 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -63.33 -7.37 6.18 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.716 0.294 . . . . 0.0 110.737 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.902 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 2.4 tpt -87.09 -48.56 7.98 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 122.632 1.206 . . . . 0.0 107.968 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.902 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -75.81 -36.75 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.08 0 CA-C-N 112.988 -1.915 . . . . 0.0 112.926 -177.81 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.43 -46.17 87.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 122.313 1.054 . . . . 0.0 108.585 177.129 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.42 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -60.07 -44.68 95.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 CA-C-N 112.919 -1.946 . . . . 0.0 110.759 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.709 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -51.11 -39.48 56.27 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.352 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.95 HD13 HD21 ' A' ' 15' ' ' LEU . 12.9 mt -73.28 -30.34 63.35 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.318 -178.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -76.5 -19.47 57.94 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -129.73 20.44 5.55 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.686 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -72.8 134.11 44.78 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.727 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 2.3 mmpt? . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.558 -0.734 . . . . 0.0 111.453 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.84 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.783 0.325 . . . . 0.0 111.479 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.53 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 98.1 m95 -70.85 163.96 26.28 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.635 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.9 tp -163.74 142.99 8.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.501 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.794 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -123.79 134.59 53.61 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.699 178.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.765 HD11 HG21 ' B' ' 30' ' ' ILE . 1.8 pt -150.05 179.3 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.45 ' C ' HD22 ' A' ' 7' ' ' LEU . 76.9 t-105 -95.9 92.66 6.62 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -177.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.887 HD11 HG22 ' B' ' 30' ' ' ILE . 1.5 mm? -122.91 114.61 20.68 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 176.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.755 ' O ' HD23 ' A' ' 12' ' ' LEU . 27.0 p -72.68 -179.58 3.14 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.421 0.629 . . . . 0.0 110.27 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.489 ' O ' HG22 ' A' ' 11' ' ' THR . 3.8 p-10 -60.55 -160.48 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.379 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.523 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.87 43.27 0.27 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 123.634 0.773 . . . . 0.0 113.006 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.698 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t 177.44 -50.28 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.64 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.89 HD21 ' HD2' ' B' ' 1' ' ' ARG . 0.7 OUTLIER -70.84 -30.79 67.3 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 175.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -89.24 -37.93 14.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.566 -1.652 . . . . 0.0 107.936 176.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.698 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -50.61 -17.42 0.51 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.335 -1.302 . . . . 0.0 111.156 178.639 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.012 HD21 HD13 ' B' ' 34' ' ' LEU . 49.1 mt -69.04 25.75 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 179.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -97.94 -54.27 3.14 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.608 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -71.32 -21.47 62.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.282 179.144 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.952 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 8.6 mtm -90.77 -23.05 20.76 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.709 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.723 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -101.13 -64.77 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.545 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 -54.12 -67.18 0.28 Allowed 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.608 ' HG3' ' HE3' ' A' ' 17' ' ' LYS . 13.6 mmp_? -51.22 -29.13 13.32 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.422 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 18' ' ' MET . 20.7 mm-40 -89.91 -8.24 52.3 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.255 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.82 -6.88 76.7 Favored Glycine 0 C--N 1.34 0.761 0 C-N-CA 120.69 -0.766 . . . . 0.0 111.721 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.723 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.9 mt -74.67 173.79 9.99 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.582 0.706 . . . . 0.0 111.485 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.5 p -117.57 168.18 10.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.455 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.553 ' NZ ' HD11 ' B' ' 3' ' ' LEU . 4.5 mmmm -46.39 -39.77 10.97 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.63 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 2.3 m -84.56 -52.34 6.2 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.132 0.173 . . . . 0.0 111.408 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.442 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.3 mm-40 -62.55 -7.28 4.39 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.7 0.286 . . . . 0.0 110.738 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.952 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.8 tpt -87.1 -48.5 8.03 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 122.657 1.218 . . . . 0.0 107.97 177.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.118 HG21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -76.12 -37.94 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.981 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.911 -177.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.437 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -62.92 -45.22 93.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 122.335 1.064 . . . . 0.0 108.604 176.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -62.23 -42.9 97.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.38 0 CA-C-N 112.85 -1.977 . . . . 0.0 111.328 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.723 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.39 -35.39 28.04 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.521 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.027 HD13 HD21 ' B' ' 15' ' ' LEU . 15.3 mt -76.45 -31.11 57.65 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.35 -178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -77.68 -16.49 58.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -126.57 16.85 7.56 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.512 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.3 OUTLIER -70.51 137.75 50.46 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 178.128 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.848 -1.072 . . . . 0.0 112.265 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.89 ' HD2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 120.829 0.347 . . . . 0.0 111.487 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -71.83 156.66 39.05 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.015 0.436 . . . . 0.0 110.065 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.553 HD11 ' NZ ' ' A' ' 26' ' ' LYS . 4.8 tp -159.38 139.23 11.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.157 -178.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.794 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -122.8 133.94 54.43 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.218 179.439 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.118 HD12 HG21 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -154.79 -176.8 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.699 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.768 ' O ' HD13 ' B' ' 7' ' ' LEU . 70.6 t-105 -92.51 88.2 6.26 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -177.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 1.033 HD11 HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -127.33 96.62 4.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.84 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 31.0 p -65.94 179.93 0.82 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.882 0.849 . . . . 0.0 112.806 -177.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -50.62 -54.14 25.15 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.337 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -49.82 -26.14 3.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.583 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 25.3 p -90.97 -28.85 17.76 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' B' ' 8' ' ' SER . 21.1 mt -76.24 -39.35 54.72 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -60.21 -41.03 92.14 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 113.643 -1.617 . . . . 0.0 107.229 175.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.606 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -53.94 -40.2 66.57 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 114.259 -1.337 . . . . 0.0 109.906 178.231 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.027 HD21 HD13 ' A' ' 34' ' ' LEU . 39.2 mt -77.01 29.41 0.13 Allowed 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.41 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 40.6 mt-10 -99.5 -61.18 1.4 Allowed 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -74.34 -22.99 58.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.439 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.729 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.9 mtm -85.65 -21.61 28.32 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.055 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.845 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.91 -67.5 0.84 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.41 ' HE ' ' HA ' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -55.81 -63.04 1.3 Allowed 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.969 0.414 . . . . 0.0 111.558 -179.152 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.22 -33.95 9.41 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.513 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 18' ' ' MET . 13.7 mm-40 -76.22 -28.96 57.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.571 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 102.88 -12.41 56.2 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 121.201 -0.523 . . . . 0.0 113.012 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.845 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -87.86 -174.51 4.76 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -179.341 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.0 p -105.02 167.28 9.81 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.93 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' B' ' 29' ' ' MET . 0.4 OUTLIER -49.8 -37.8 31.7 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.469 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.45 ' O ' HD11 ' A' ' 7' ' ' LEU . 4.3 m -79.03 -55.88 4.8 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.411 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.9 mt-10 -56.36 -20.12 17.79 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.729 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.6 tpt -70.87 -46.68 62.21 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 122.61 1.195 . . . . 0.0 108.68 177.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.887 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -75.57 -31.55 23.47 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.298 0 CA-C-N 113.047 -1.888 . . . . 0.0 113.254 -177.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.533 ' OD1' HG21 ' A' ' 11' ' ' THR . 0.0 OUTLIER -65.78 -46.47 78.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 122.397 1.094 . . . . 0.0 108.339 176.318 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.408 ' N ' HD22 ' B' ' 31' ' ' ASN . 1.6 t -58.36 -44.69 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-N 112.711 -2.04 . . . . 0.0 111.142 -179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.73 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -51.08 -32.18 21.41 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.63 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.012 HD13 HD21 ' A' ' 15' ' ' LEU . 18.6 mt -79.2 -31.39 43.77 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.857 -178.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -78.8 -16.3 57.32 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.0 m80 -124.99 16.88 8.53 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 178.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.487 ' CE1' ' HB2' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -69.96 138.93 52.73 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.119 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.487 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.171 0 CA-C-O 118.83 -0.605 . . . . 0.0 111.902 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -98.57 105.63 17.8 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.8 tp -125.54 139.25 53.77 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.712 -178.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 6.5 m -96.0 139.51 32.08 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 1.08 HD13 HG21 ' B' ' 30' ' ' ILE . 1.1 pp -152.12 174.06 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-O 121.125 0.488 . . . . 0.0 112.227 -178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.769 ' O ' HD13 ' A' ' 7' ' ' LEU . 70.8 t-105 -90.34 106.76 18.71 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.355 1.243 . . . . 0.0 114.355 -176.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.04 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -133.15 115.65 15.31 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 177.446 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.559 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.6 p -89.37 -173.77 4.13 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.494 0.664 . . . . 0.0 111.875 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -49.65 -58.01 6.1 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.025 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -50.86 -27.28 7.09 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -179.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.61 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 28.1 p -91.83 -31.23 15.8 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 113.205 0.816 . . . . 0.0 113.205 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 8' ' ' SER . 46.1 mt -72.17 -40.55 67.88 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.49 -41.2 98.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 113.65 -1.614 . . . . 0.0 108.079 176.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.61 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.16 -44.88 61.55 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.404 178.949 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.101 HD22 ' CG ' ' A' ' 29' ' ' MET . 22.9 mt -79.41 24.87 0.33 Allowed 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -104.47 -58.81 1.83 Allowed 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.4 mttp -73.86 -32.03 63.44 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.425 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.561 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 43.1 mtm -74.09 -61.72 1.75 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.224 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.845 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -51.8 -48.38 63.87 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.9 mtp-105 -58.87 -66.68 0.46 Allowed 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 121.031 0.443 . . . . 0.0 111.218 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.55 -32.11 17.57 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.572 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 18' ' ' MET . 13.8 mm-40 -75.59 -26.12 57.61 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.815 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.19 13.44 80.82 Favored Glycine 0 C--N 1.336 0.574 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.949 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.845 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -110.32 177.56 4.66 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 111.854 -179.828 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.3 p -104.03 165.68 10.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.723 -178.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.478 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 6.9 mttm -40.74 -41.39 1.53 Allowed 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.582 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 85.3 p -73.43 -59.3 2.78 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.326 0.108 . . . . 0.0 111.022 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.549 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 1.8 mm-40 -57.21 -22.07 38.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.176 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 1.101 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -71.67 -48.43 47.61 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 122.891 1.329 . . . . 0.0 108.751 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.903 HG21 HD13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -76.32 -31.74 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.266 0 CA-C-N 112.713 -2.039 . . . . 0.0 114.185 -176.588 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.443 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.2 OUTLIER -70.17 -47.29 62.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 122.155 0.979 . . . . 0.0 109.797 178.383 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.549 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.5 t -65.02 -39.14 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-N 113.309 -1.768 . . . . 0.0 111.122 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.705 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -42.87 -61.56 1.24 Allowed 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.419 -1.264 . . . . 0.0 112.169 -179.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.864 ' HB3' ' HB2' ' B' ' 33' ' ' ALA . 0.0 OUTLIER -75.07 -28.69 60.45 Favored 'General case' 0 N--CA 1.432 -1.37 0 C-N-CA 119.188 -1.005 . . . . 0.0 112.636 -177.019 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.858 ' N ' HD22 ' A' ' 34' ' ' LEU . 8.1 mt-30 -58.17 -20.22 39.18 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.333 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 24.6 m80 -120.41 25.09 10.02 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.2 0.524 . . . . 0.0 109.683 175.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.695 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -91.5 141.21 28.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.153 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.152 0 C-N-CA 123.471 0.708 . . . . 0.0 112.16 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 2.1 mpt_? . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.858 0.361 . . . . 0.0 111.679 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -109.98 109.27 19.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.475 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.4 tp -134.46 144.25 48.0 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.914 -1.039 . . . . 0.0 111.205 -178.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -96.46 137.1 36.04 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.903 HD13 HG21 ' A' ' 30' ' ' ILE . 4.4 pt -137.41 170.84 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.582 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 75.1 t-105 -100.31 106.81 18.47 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -177.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.784 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.7 OUTLIER -126.85 114.64 18.17 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.585 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 14.3 p -83.04 178.11 8.29 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.814 0.816 . . . . 0.0 112.13 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -51.7 -50.73 59.89 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.921 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -45.46 -35.68 3.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.474 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.819 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -104.7 -14.22 15.65 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' B' ' 8' ' ' SER . 94.1 mt -65.07 -39.25 92.97 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -64.13 -43.93 93.76 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 113.496 -1.684 . . . . 0.0 107.98 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.819 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -52.67 -40.29 62.74 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.545 178.839 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.743 HD22 ' CG ' ' B' ' 29' ' ' MET . 14.6 mt -77.95 28.96 0.17 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -104.16 -61.54 1.43 Allowed 'General case' 0 N--CA 1.461 0.11 0 N-CA-C 110.309 -0.256 . . . . 0.0 110.309 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.51 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 16.6 mtpp -71.87 -21.74 61.61 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.345 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.795 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 25.7 mtm -90.22 -24.72 20.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.399 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.702 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -104.16 -64.38 1.11 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.515 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 10.7 mtp-105 -60.16 -65.74 0.63 Allowed 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 120.998 0.428 . . . . 0.0 111.69 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.51 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -50.6 -33.43 22.06 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.421 179.826 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' B' ' 18' ' ' MET . 16.1 mm-40 -84.84 -11.18 56.22 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.174 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.08 -5.67 84.74 Favored Glycine 0 C--N 1.339 0.737 0 C-N-CA 120.649 -0.786 . . . . 0.0 111.856 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.886 HD22 ' HB3' ' B' ' 28' ' ' GLU . 72.4 mt -75.49 175.58 8.36 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.568 0.699 . . . . 0.0 111.295 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 10.6 p -119.76 174.5 6.39 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.652 -1.158 . . . . 0.0 108.8 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.486 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.0 mttm -51.14 -29.54 13.84 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 111.687 0.254 . . . . 0.0 111.687 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.636 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 34.5 m -82.51 -60.58 2.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.529 0.332 . . . . 0.0 111.496 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.886 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.6 mt-10 -61.03 -9.19 4.01 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.221 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.795 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.9 tpt -86.58 -46.62 9.95 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 107.134 -1.432 . . . . 0.0 107.134 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 1.08 HG21 HD13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -75.22 -32.89 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.992 0 CA-C-N 113.042 -1.89 . . . . 0.0 113.282 -178.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.487 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -70.78 -50.37 36.51 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 122.119 0.961 . . . . 0.0 109.203 177.776 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.487 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.5 t -54.79 -40.31 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.344 0 CA-C-N 113.212 -1.813 . . . . 0.0 109.844 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.864 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . . . -44.44 -43.69 7.94 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 113.894 -1.503 . . . . 0.0 111.242 178.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.908 HD13 HD21 ' A' ' 15' ' ' LEU . 9.4 mt -78.54 -29.25 46.29 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.148 -177.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -70.66 -25.43 63.0 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -133.4 21.65 4.0 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.575 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -64.58 140.21 58.84 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 177.778 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.479 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.661 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.997 ' HD3' HD21 ' B' ' 12' ' ' LEU . 1.5 ttt-85 . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -86.35 118.57 25.87 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 177.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.545 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 mm? -131.46 148.92 52.69 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.436 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.869 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -117.04 128.6 55.32 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.673 ' CD1' HG21 ' B' ' 30' ' ' ILE . 2.4 pp -154.92 172.41 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 CA-C-O 120.774 0.321 . . . . 0.0 111.387 -178.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.613 ' O ' ' HB2' ' B' ' 27' ' ' SER . 57.9 t-105 -79.56 78.21 6.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.553 0.692 . . . . 0.0 111.088 -179.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.026 HD11 HG21 ' A' ' 11' ' ' THR . 54.2 tp -115.54 76.14 0.99 Allowed 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 178.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.755 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 24.3 p -76.1 -145.04 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.475 -177.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.13 -155.28 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.616 -0.72 . . . . 0.0 112.245 -178.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.53 44.43 0.11 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.323 0.649 . . . . 0.0 112.299 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 1.026 HG21 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -178.5 -50.34 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.432 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.563 HD21 HD22 ' B' ' 3' ' ' LEU . 19.1 mt -70.17 -41.09 74.23 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 175.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -79.09 -39.78 32.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 113.037 -1.892 . . . . 0.0 108.323 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.759 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -50.6 -29.08 10.01 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.796 178.623 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.281 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -77.38 31.8 0.15 Allowed 'General case' 0 N--CA 1.427 -1.603 0 C-N-CA 124.217 1.007 . . . . 0.0 112.929 179.71 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -76.61 -59.81 2.61 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -96.71 13.13 29.45 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.706 ' HB2' HD13 ' A' ' 15' ' ' LEU . 8.5 mtm -102.08 -76.68 0.57 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.09 0.405 . . . . 0.0 111.271 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.904 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -26.39 -32.87 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 126.507 1.923 . . . . 0.0 114.377 -178.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 31.4 mmm-85 -66.92 -122.72 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.344 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -53.21 -21.94 5.96 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 121.973 -0.454 . . . . 0.0 111.881 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -113.53 -1.55 14.08 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 115.594 1.701 . . . . 0.0 115.594 -176.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.835 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -143.87 14.09 2.17 Favored Glycine 0 CA--C 1.502 -0.733 0 C-N-CA 116.197 -2.906 . . . . 0.0 116.852 -176.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.539 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.1 mp 53.34 -161.52 0.12 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 119.312 1.556 . . . . 0.0 112.953 176.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.1 t -65.09 167.57 7.82 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.171 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -43.05 64.19 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' B' ' 6' ' ' TRP . 23.7 p -83.81 -47.52 11.03 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.892 -0.14 . . . . 0.0 111.086 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -56.04 -30.5 62.0 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 1.281 ' SD ' HD11 ' A' ' 15' ' ' LEU . 4.7 tpt -59.83 -47.83 84.12 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 122.69 1.233 . . . . 0.0 109.952 177.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.105 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -79.34 -27.09 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.508 0 CA-C-N 112.828 -1.987 . . . . 0.0 114.099 -175.471 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.618 ' OD1' HG21 ' B' ' 11' ' ' THR . 0.0 OUTLIER -70.62 -48.68 53.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 122.286 1.041 . . . . 0.0 108.82 176.664 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.436 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 1.7 t -60.17 -46.19 94.91 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-N 112.986 -1.916 . . . . 0.0 111.553 -179.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.877 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -45.54 -40.6 8.84 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.236 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.97 HD21 ' HB2' ' B' ' 33' ' ' ALA . 11.4 mt -80.5 -28.8 37.39 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.245 -177.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -71.91 -13.94 61.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.509 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 12.6 m80 -129.83 46.25 2.68 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.572 0.225 . . . . 0.0 111.153 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.742 ' HA ' ' CD2' ' B' ' 36' ' ' HIS . 0.8 OUTLIER -60.46 132.12 52.89 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.312 0.577 . . . . 0.0 112.025 179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.633 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.9 mmmt . . . . . 0 C--O 1.249 1.066 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.889 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.755 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 121.028 0.442 . . . . 0.0 111.806 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.4 173.6 4.77 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.191 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.948 ' CD2' HD23 ' A' ' 7' ' ' LEU . 2.1 tp -173.4 150.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.738 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.869 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.9 OUTLIER -129.47 130.66 46.15 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.463 178.689 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.872 ' CD1' HG21 ' A' ' 30' ' ' ILE . 5.4 pt -144.47 176.66 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.499 ' C ' HD22 ' B' ' 7' ' ' LEU . 76.4 t-105 -103.05 98.4 8.35 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 1.105 HD11 HG22 ' A' ' 30' ' ' ILE . 1.0 OUTLIER -125.55 126.98 45.68 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 175.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.509 ' O ' HD23 ' B' ' 12' ' ' LEU . 2.3 t -81.87 -150.46 0.08 Allowed 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.141 -0.624 . . . . 0.0 109.496 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . 0.432 ' O ' HG22 ' B' ' 11' ' ' THR . 0.7 OUTLIER -87.56 -163.56 0.96 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -178.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . 0.443 ' O ' ' HB ' ' B' ' 11' ' ' THR . 2.2 tt0 35.77 39.14 0.06 Allowed 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 123.448 0.699 . . . . 0.0 112.309 179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.682 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 1.9 t -176.57 -52.36 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.671 179.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.997 HD21 ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -67.93 -33.15 74.13 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.266 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.579 ' N ' HD12 ' B' ' 12' ' ' LEU . 29.6 mt-10 -96.41 -37.64 10.37 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.062 -1.426 . . . . 0.0 109.271 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.682 ' HB2' ' N ' ' B' ' 11' ' ' THR . 1.5 m-20 -56.7 -34.54 67.53 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 114.584 -1.189 . . . . 0.0 112.666 -178.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.925 HD12 ' CD1' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.58 -5.02 30.28 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -178.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.504 ' N ' HD22 ' B' ' 15' ' ' LEU . 10.9 mm-40 -60.11 -46.95 87.91 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.334 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -55.56 -35.59 65.9 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.101 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.518 ' CE ' ' HB2' ' B' ' 15' ' ' LEU . 34.8 mtm -69.57 -59.8 2.73 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.105 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.763 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -36.41 -46.88 0.58 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.485 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 1.5 mmm-85 -67.7 -73.73 0.13 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 tpp85 -50.86 -29.99 13.32 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.59 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.478 ' HG3' ' HB3' ' B' ' 18' ' ' MET . 25.0 mm-40 -79.29 -27.65 42.24 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.688 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.475 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 94.58 67.17 1.02 Allowed Glycine 0 C--N 1.341 0.83 0 C-N-CA 120.263 -0.97 . . . . 0.0 113.587 178.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.763 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 177.86 -176.74 0.19 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.099 0.476 . . . . 0.0 111.554 178.038 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . 0.472 ' N ' HD23 ' B' ' 24' ' ' LEU . 3.5 t -115.79 176.4 5.1 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.125 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.467 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.9 mttm -41.44 -39.53 1.53 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.613 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 26.6 p -73.3 -63.77 1.12 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.674 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.8 mm-40 -59.19 -18.6 37.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.705 0.288 . . . . 0.0 110.482 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.799 ' HG2' ' CD2' ' B' ' 15' ' ' LEU . 1.1 tpt -74.55 -48.08 28.98 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 123.793 1.758 . . . . 0.0 107.494 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.916 HG22 HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.79 -23.26 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.82 0 CA-C-N 112.79 -2.005 . . . . 0.0 112.062 -178.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -85.17 -44.74 12.68 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.741 176.779 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.771 ' CG2' ' HE3' ' B' ' 29' ' ' MET . 4.4 m -52.39 -34.59 18.87 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 CA-C-O 121.969 0.89 . . . . 0.0 109.211 178.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.97 ' HB2' HD21 ' A' ' 34' ' ' LEU . . . -37.72 -45.33 0.79 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.065 -1.879 . . . . 0.0 111.734 178.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.87 HD13 ' CD2' ' A' ' 15' ' ' LEU . 8.5 mt -83.01 -32.29 27.0 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.638 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . 0.416 HE22 ' CG ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -73.89 -21.18 60.18 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 179.873 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.922 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 8.0 p-80 -105.71 -27.84 11.07 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 178.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.653 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 12.5 t80 -52.06 149.21 5.33 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.003 0.365 . . . . 0.0 110.067 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.577 ' HD3' ' CE2' ' B' ' 37' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 123.342 0.657 . . . . 0.0 112.455 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.748 ' HD2' ' CD2' ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.727 0.299 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -70.91 128.5 36.2 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 110.301 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 5' ' ' ILE . 2.3 tp -123.93 135.75 53.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.609 -178.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.768 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -131.84 123.55 27.77 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.156 179.33 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.869 HD11 HD21 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -152.64 -173.79 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.243 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.096 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.617 ' C ' HD22 ' A' ' 7' ' ' LEU . 68.8 t-105 -91.82 92.21 8.28 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -177.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.019 HD11 HG22 ' B' ' 30' ' ' ILE . 2.0 mm? -129.56 103.37 6.84 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.642 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 28.4 p -66.3 -142.71 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 120.87 0.367 . . . . 0.0 111.515 -178.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -97.46 -147.4 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.065 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.504 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.8 tt0 32.42 45.75 0.06 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 123.312 0.645 . . . . 0.0 112.483 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.821 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.6 OUTLIER -172.53 -51.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.694 179.166 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.543 HD13 HD13 ' B' ' 3' ' ' LEU . 17.1 mt -72.19 -41.47 66.92 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -81.15 -38.79 26.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.59 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.821 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -42.83 -28.52 0.25 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-N 114.538 -1.21 . . . . 0.0 111.081 179.209 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.847 ' CD2' HD23 ' B' ' 34' ' ' LEU . 0.1 OUTLIER -65.24 9.0 0.12 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -53.56 -41.03 66.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -87.26 -24.63 24.3 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -178.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.75 ' HB2' HD12 ' A' ' 15' ' ' LEU . 4.1 mtm -97.75 -65.85 0.94 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.026 0.751 . . . . 0.0 113.026 -178.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.882 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -33.9 -31.38 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -64.99 -108.22 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 119.524 -0.87 . . . . 0.0 110.743 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -24.35 59.06 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -107.42 -21.59 12.87 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.882 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -128.52 21.27 5.42 Favored Glycine 0 CA--C 1.507 -0.46 0 C-N-CA 117.17 -2.443 . . . . 0.0 116.831 -176.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.706 HD12 ' C ' ' A' ' 23' ' ' GLY . 0.9 OUTLIER 51.0 -157.71 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 118.909 1.354 . . . . 0.0 113.192 175.223 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.461 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.1 p -62.51 159.34 15.91 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.341 -1.3 . . . . 0.0 109.468 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.46 -42.31 6.97 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.7 p -80.88 -40.97 23.87 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.686 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mm-40 -61.82 -28.39 69.44 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.125 -0.23 . . . . 0.0 110.757 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.841 ' SD ' HD21 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -67.11 -42.38 84.62 Favored 'General case' 0 CA--C 1.499 -1.016 0 CA-C-O 122.512 1.148 . . . . 0.0 108.567 177.586 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.653 HG22 ' CD1' ' B' ' 7' ' ' LEU . 0.3 OUTLIER -76.77 -35.04 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.365 0 CA-C-N 112.725 -2.034 . . . . 0.0 113.473 -175.474 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.461 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -63.97 -46.85 82.83 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 175.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -58.7 -41.27 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.154 0 CA-C-N 112.635 -2.075 . . . . 0.0 111.425 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.998 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -45.42 -41.16 8.95 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.696 -1.138 . . . . 0.0 112.119 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.887 HD22 HD21 ' B' ' 15' ' ' LEU . 7.0 mt -81.47 -29.87 33.57 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.307 -0.861 . . . . 0.0 111.961 -177.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -71.67 -17.51 62.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 33.2 m80 -118.23 39.61 3.38 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.609 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 58.1 t80 -90.01 162.81 15.19 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.219 -0.901 . . . . 0.0 112.374 -178.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.557 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.271 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.642 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.978 0.418 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -75.82 138.45 41.16 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.963 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.543 HD13 HD13 ' A' ' 12' ' ' LEU . 2.2 tp -128.33 133.13 48.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.469 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.768 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.0 OUTLIER -126.19 123.78 38.99 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 178.776 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.86 HG13 HD21 ' B' ' 7' ' ' LEU . 1.6 pt -154.29 175.69 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.441 ' O ' HD13 ' B' ' 7' ' ' LEU . 75.3 t-105 -88.57 96.13 10.51 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -177.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.86 HD21 HG13 ' B' ' 5' ' ' ILE . 1.1 mm? -119.5 118.93 32.39 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.734 ' O ' HD23 ' B' ' 12' ' ' LEU . 44.9 p -65.7 164.97 13.41 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-O 121.995 0.903 . . . . 0.0 111.165 -178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . 0.441 ' HA ' ' CD2' ' B' ' 12' ' ' LEU . 8.3 t70 -64.45 -37.9 89.16 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 113.633 -1.621 . . . . 0.0 112.924 -177.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -73.16 38.75 0.09 Allowed 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.806 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 7.9 t -174.17 -51.54 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 122.975 0.51 . . . . 0.0 111.877 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.748 ' CD2' ' HD2' ' A' ' 1' ' ' ARG . 0.4 OUTLIER -57.54 -28.61 63.68 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 176.674 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 68.7 mm-40 -84.23 -38.9 19.96 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.393 177.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.806 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 1.2 t70 -44.14 -29.58 0.64 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.829 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.887 HD21 HD22 ' A' ' 34' ' ' LEU . 28.9 mt -79.4 27.07 0.27 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.425 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.1 OUTLIER -111.46 -52.18 2.8 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.247 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.418 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -76.93 -32.68 57.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 120.835 0.35 . . . . 0.0 110.597 178.812 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.467 ' HE3' ' CG ' ' A' ' 37' ' ' TYR . 0.8 OUTLIER -97.25 20.64 11.14 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.111 179.32 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.91 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -100.03 -19.79 16.36 Favored 'General case' 0 C--O 1.214 -0.779 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.431 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 39.1 mmm-85 -65.67 -126.35 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.726 0 O-C-N 121.657 -0.652 . . . . 0.0 110.468 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -52.69 -22.85 5.64 Favored 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 121.681 -0.637 . . . . 0.0 110.439 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -93.64 -23.43 18.27 Favored 'General case' 0 CA--C 1.522 -0.127 0 N-CA-C 114.155 1.169 . . . . 0.0 114.155 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.91 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -134.99 16.28 4.22 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 117.19 -2.433 . . . . 0.0 116.369 -177.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.733 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.0 OUTLIER 55.56 -166.18 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.653 1.226 . . . . 0.0 113.667 175.846 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.1 m -53.94 149.56 8.88 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.145 178.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -41.8 -46.44 3.9 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.621 ' O ' HD11 ' A' ' 7' ' ' LEU . 74.5 p -75.87 -44.13 42.19 Favored 'General case' 0 C--O 1.23 0.057 0 CA-C-O 120.652 0.263 . . . . 0.0 110.702 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.653 ' O ' HG22 ' B' ' 32' ' ' VAL . 3.6 mt-10 -54.78 -38.68 67.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.74 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.865 ' HE3' HG23 ' B' ' 32' ' ' VAL . 4.0 tpt -57.89 -47.21 83.45 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 123.623 1.678 . . . . 0.0 108.935 177.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 1.019 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -65.9 -21.45 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.667 0 CA-C-N 112.972 -1.922 . . . . 0.0 112.649 -178.099 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.582 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -83.53 -46.36 12.52 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 177.49 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.865 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -58.66 -30.3 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.062 0 CA-C-O 121.878 0.847 . . . . 0.0 109.009 177.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 1.001 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.15 -54.71 1.73 Allowed 'General case' 0 CA--C 1.495 -1.14 0 CA-C-N 113.599 -1.637 . . . . 0.0 108.729 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.103 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -67.44 -46.72 72.26 Favored 'General case' 0 N--CA 1.399 -2.976 0 CA-C-N 114.213 -1.358 . . . . 0.0 110.243 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . 1.103 ' N ' HD13 ' B' ' 34' ' ' LEU . 4.6 mt-30 -64.21 -59.33 4.55 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 1.001 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.3 p80 -65.87 -16.41 63.81 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.728 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.8 OUTLIER -55.83 137.69 49.62 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.577 0.351 . . . . 0.0 110.298 178.682 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.474 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.88 -0.581 . . . . 0.0 112.067 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.82 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.775 0.322 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.482 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.5 m95 -78.95 165.76 23.12 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.427 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 tp -171.34 147.29 2.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.238 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.932 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -108.57 140.32 42.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.947 ' CD1' HG21 ' B' ' 30' ' ' ILE . 3.8 pt -147.92 176.64 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.715 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 76.6 t-105 -100.86 100.77 11.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -177.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.815 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.7 OUTLIER -131.18 114.62 15.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.77 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -88.54 -167.11 1.78 Allowed 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.422 0.63 . . . . 0.0 112.303 -178.209 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -50.85 -57.99 7.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.784 -1.098 . . . . 0.0 112.419 -178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -48.25 -29.55 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.623 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 69.8 p -95.26 -33.39 12.59 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 8' ' ' SER . 69.9 mt -67.94 -40.69 83.23 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 178.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -59.98 -43.91 94.81 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.749 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.623 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -57.06 -51.62 68.53 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.395 -1.275 . . . . 0.0 109.564 178.236 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.982 HD22 ' CG ' ' A' ' 29' ' ' MET . 14.8 mt -78.15 24.56 0.25 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.87 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.448 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -114.99 -52.96 2.67 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 178.454 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.448 ' HG2' ' HG2' ' A' ' 16' ' ' GLU . 0.8 OUTLIER -87.49 -32.82 19.25 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 122.667 0.387 . . . . 0.0 110.782 178.522 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.752 ' HE1' ' HB2' ' B' ' 34' ' ' LEU . 0.5 OUTLIER -91.73 6.04 47.49 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.46 179.619 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.875 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -97.21 -15.53 20.81 Favored 'General case' 0 C--O 1.211 -0.928 0 C-N-CA 122.669 0.388 . . . . 0.0 111.737 179.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.429 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -68.35 -124.55 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.785 179.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 tpp85 -52.29 -25.13 8.7 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 118.606 0.639 . . . . 0.0 110.296 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -92.04 -20.05 21.72 Favored 'General case' 0 CA--C 1.519 -0.246 0 N-CA-C 114.498 1.295 . . . . 0.0 114.498 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.875 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -142.58 19.56 2.41 Favored Glycine 0 CA--C 1.504 -0.612 0 C-N-CA 116.64 -2.695 . . . . 0.0 116.564 -177.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.737 HD12 ' C ' ' A' ' 23' ' ' GLY . 0.9 OUTLIER 50.73 -161.52 0.07 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.879 1.339 . . . . 0.0 113.54 175.624 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.488 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 9.8 p -60.48 156.78 15.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.658 -1.156 . . . . 0.0 109.666 178.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.55 -40.15 2.56 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.447 ' OG ' HG22 ' B' ' 5' ' ' ILE . 29.3 m -79.68 -49.36 12.21 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.247 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.73 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.2 mm-40 -55.49 -30.41 60.57 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.387 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.982 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -61.01 -50.84 71.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.069 1.414 . . . . 0.0 108.767 177.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.011 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -71.81 -34.66 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.523 0 CA-C-N 112.929 -1.941 . . . . 0.0 114.133 -177.084 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.42 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.25 -47.98 72.0 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.872 0.844 . . . . 0.0 109.092 177.284 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.534 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.12 -39.43 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-N 113.684 -1.598 . . . . 0.0 111.445 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.577 ' O ' ' HB1' ' B' ' 33' ' ' ALA . . . -47.56 -40.37 18.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.063 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.004 HD13 ' CD2' ' B' ' 15' ' ' LEU . 11.9 mt -78.51 -28.47 46.25 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.364 -177.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.418 ' HB3' HE21 ' A' ' 35' ' ' GLN . 0.0 OUTLIER -77.23 -18.83 57.37 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.6 m80 -104.75 -38.79 6.56 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.539 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 24.6 t80 -44.32 153.6 0.15 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.954 0.407 . . . . 0.0 111.966 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.522 ' N ' ' CG ' ' A' ' 37' ' ' TYR . 9.3 mmmt . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.493 -0.765 . . . . 0.0 111.364 177.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.77 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 1.2 mpt_? . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.194 0.521 . . . . 0.0 111.861 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 74.4 m95 -114.66 105.04 12.59 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 177.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.468 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 1.5 tp -126.49 146.57 50.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.819 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.932 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -106.01 136.73 45.15 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.921 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.011 HD12 HG21 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -148.41 -177.57 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.403 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.666 ' O ' HD13 ' B' ' 7' ' ' LEU . 65.7 t-105 -92.28 90.13 7.14 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.907 HD11 HG22 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -127.01 94.41 4.02 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.82 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 42.6 p -64.58 177.54 0.89 Allowed 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.79 0.805 . . . . 0.0 112.342 -177.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -52.87 -50.07 64.54 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.196 -1.365 . . . . 0.0 111.67 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.0 -26.55 6.18 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.642 ' O ' ' HG ' ' B' ' 15' ' ' LEU . 26.1 p -92.45 -25.65 18.35 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.455 HD11 ' HE ' ' A' ' 1' ' ' ARG . 22.7 mt -77.88 -40.71 39.12 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.72 -40.95 89.7 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 113.957 -1.474 . . . . 0.0 107.233 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.548 ' O ' ' HG3' ' B' ' 18' ' ' MET . 41.8 t0 -54.82 -39.22 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 114.016 -1.447 . . . . 0.0 110.276 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.004 ' CD2' HD13 ' A' ' 34' ' ' LEU . 32.1 mt -76.96 27.72 0.14 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.486 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 47.4 mt-10 -99.82 -54.46 2.9 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -77.48 -22.0 51.97 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.51 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.895 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 11.3 mtm -91.29 -24.21 19.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.944 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.713 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.32 -66.51 0.91 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.486 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -54.7 -67.82 0.24 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -179.419 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.83 -31.44 11.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.405 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.504 ' HB2' ' O ' ' B' ' 18' ' ' MET . 15.9 mm-40 -87.95 -9.94 52.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 112.261 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.26 -3.39 86.25 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.855 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.713 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 87.3 mt -75.74 172.65 12.28 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 121.532 0.682 . . . . 0.0 111.6 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 60.4 p -115.47 163.4 15.79 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 mttm -42.16 -41.56 2.71 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.715 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 4.3 m -84.77 -50.5 7.53 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.626 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.5 mt-10 -64.49 -7.98 12.07 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.732 0.301 . . . . 0.0 110.245 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.947 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.0 tpt -85.37 -47.15 10.27 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-O 122.639 1.209 . . . . 0.0 108.028 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.947 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.4 OUTLIER -75.86 -40.96 39.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 112.971 -1.922 . . . . 0.0 113.141 -177.436 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.45 -44.76 95.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.972 0.891 . . . . 0.0 109.658 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.626 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -70.49 -32.86 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.158 0 CA-C-N 113.714 -1.585 . . . . 0.0 112.545 -179.208 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.729 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -54.7 -53.14 58.87 Favored 'General case' 0 CA--C 1.501 -0.916 0 CA-C-O 121.889 0.852 . . . . 0.0 110.163 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.934 HD22 HD21 ' A' ' 15' ' ' LEU . 4.0 pp -72.27 -25.52 61.63 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 113.744 -1.571 . . . . 0.0 112.033 -178.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . 0.713 ' N ' HD12 ' B' ' 34' ' ' LEU . 0.0 OUTLIER -66.94 -19.75 65.78 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.389 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 55.0 m80 -116.27 24.37 11.44 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 175.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -95.87 143.96 26.63 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.323 0.649 . . . . 0.0 110.124 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.499 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.724 -0.655 . . . . 0.0 112.225 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.776 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.071 0.462 . . . . 0.0 111.881 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -112.3 111.04 21.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.263 177.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -127.3 144.08 51.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.362 -178.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.825 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -109.9 136.65 48.86 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.434 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.797 ' CD1' HD21 ' A' ' 7' ' ' LEU . 1.8 pt -150.08 176.82 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.465 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.3 t-105 -93.61 90.91 6.82 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 -177.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.797 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.8 OUTLIER -124.64 104.14 8.52 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 177.126 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.558 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 6.9 t -78.77 -139.1 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -80.59 -160.09 0.28 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.258 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.41 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 1.9 tt0 35.07 45.07 0.16 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-O 121.538 0.685 . . . . 0.0 111.667 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.782 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.65 -52.33 0.02 OUTLIER 'General case' 0 C--O 1.23 0.079 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.893 -179.766 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.576 HD11 ' O ' ' A' ' 7' ' ' LEU . 18.1 mt -73.93 -42.09 61.11 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -76.44 -39.37 53.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 113.125 -1.852 . . . . 0.0 108.207 176.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.782 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -45.16 -38.69 5.45 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 114.409 -1.268 . . . . 0.0 110.302 178.896 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.907 HD12 ' HB2' ' A' ' 19' ' ' ALA . 3.0 mm? -68.68 7.01 0.72 Allowed 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -62.42 -39.81 94.51 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -102.09 -10.85 19.32 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.727 ' HB2' HD13 ' A' ' 15' ' ' LEU . 29.4 mtm -97.91 -66.11 0.92 Allowed 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.913 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -36.87 -29.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 20.8 mmm-85 -64.69 -109.76 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.437 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -25.07 64.53 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.676 0.274 . . . . 0.0 111.692 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 18' ' ' MET . 22.8 mm-40 -105.48 -11.13 16.54 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 -177.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.913 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -138.97 17.66 3.19 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 116.553 -2.737 . . . . 0.0 116.63 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.694 HD12 ' C ' ' A' ' 23' ' ' GLY . 0.8 OUTLIER 49.91 -157.61 0.09 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 119.054 1.427 . . . . 0.0 112.739 175.56 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.5 p -61.14 160.27 10.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.269 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.22 -39.29 13.79 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.679 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 69.5 m -79.04 -44.55 21.96 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 111.72 0.266 . . . . 0.0 111.72 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 9.8 mm-40 -61.72 -31.31 71.47 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.907 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.723 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -64.26 -38.8 92.34 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.771 1.272 . . . . 0.0 107.77 177.029 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.088 HG21 HD12 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -76.18 -17.98 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.4 -2.97 0 CA-C-N 112.744 -2.025 . . . . 0.0 113.569 -176.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.532 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -73.18 -51.97 15.86 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.115 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.532 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 7.3 p -65.95 -28.46 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.441 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.798 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -41.97 -42.44 2.81 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.811 177.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.855 HD21 HD13 ' B' ' 30' ' ' ILE . 9.0 mt -84.49 -27.7 27.25 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.259 -0.882 . . . . 0.0 112.157 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.428 ' HB2' ' HA ' ' A' ' 32' ' ' VAL . 31.2 mt-30 -63.53 -32.58 74.08 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.798 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 14.0 p-80 -97.91 -38.11 9.54 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 118.339 0.518 . . . . 0.0 112.178 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.563 ' CG ' ' HA ' ' B' ' 33' ' ' ALA . 21.4 t80 -45.87 141.18 3.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.129 0 C-N-CA 123.678 0.791 . . . . 0.0 112.269 178.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.558 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 120.725 0.298 . . . . 0.0 111.724 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -100.28 114.16 27.42 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 tp -133.07 145.4 50.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.643 -178.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.825 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -111.6 136.34 50.94 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.088 HD12 HG21 ' A' ' 30' ' ' ILE . 1.5 pt -147.04 -176.89 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.718 ' O ' HD13 ' B' ' 7' ' ' LEU . 71.0 t-105 -98.69 98.49 9.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.984 HD11 HG23 ' A' ' 30' ' ' ILE . 0.8 OUTLIER -131.14 108.8 9.99 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.575 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.776 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -92.52 -164.96 1.25 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.436 0.636 . . . . 0.0 112.053 -178.225 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -45.15 -62.57 1.2 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.513 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -50.79 -29.75 12.39 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.567 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 68.6 p -88.46 -34.74 17.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' B' ' 8' ' ' SER . 45.0 mt -69.95 -40.01 75.72 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -61.95 -41.92 98.53 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.783 -1.553 . . . . 0.0 107.736 175.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.567 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.4 OUTLIER -53.35 -49.43 67.15 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.003 178.516 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.891 HD22 ' CG ' ' B' ' 29' ' ' MET . 17.9 mt -73.76 8.38 1.97 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.74 -40.1 8.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.72 -26.59 29.62 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.822 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 14.0 mtm -86.23 -64.43 1.15 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.752 -0.204 . . . . 0.0 111.4 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.582 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -47.89 -43.94 29.12 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.683 0.393 . . . . 0.0 111.871 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.449 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 24.0 mmm-85 -61.01 -68.76 0.28 Allowed 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 111.597 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -31.64 37.25 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.95 179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.484 ' HB3' ' HG ' ' B' ' 24' ' ' LEU . 20.7 mm-40 -86.51 -10.47 54.04 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.289 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.15 14.22 68.21 Favored Glycine 0 C--N 1.341 0.809 0 C-N-CA 120.499 -0.858 . . . . 0.0 111.582 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.582 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 90.5 mt -86.8 166.77 14.97 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.56 0.695 . . . . 0.0 111.844 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 83.7 p -103.44 164.34 11.71 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.355 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -43.54 -35.98 1.89 Allowed 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -179.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.59 -56.63 3.41 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 -179.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.555 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.1 mt-10 -58.89 -15.34 12.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.612 0.244 . . . . 0.0 110.386 179.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.891 ' CG ' HD22 ' B' ' 15' ' ' LEU . 1.7 tpt -79.29 -48.1 14.72 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 122.6 1.19 . . . . 0.0 108.227 177.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.855 HD13 HD21 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.58 -33.89 27.93 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.037 0 CA-C-N 113.191 -1.822 . . . . 0.0 113.436 -177.36 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.408 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -67.65 -45.93 73.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.798 0.809 . . . . 0.0 109.933 178.291 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.0 OUTLIER -66.77 -37.43 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.238 0 CA-C-N 114.277 -1.329 . . . . 0.0 112.192 -178.916 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.563 ' HA ' ' CG ' ' A' ' 37' ' ' TYR . . . -61.26 -47.54 85.55 Favored 'General case' 0 CA--C 1.497 -1.082 0 CA-C-O 122.031 0.92 . . . . 0.0 109.662 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.048 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -68.98 -42.8 76.07 Favored 'General case' 0 N--CA 1.401 -2.881 0 CA-C-N 113.34 -1.755 . . . . 0.0 111.121 -177.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . 1.048 ' N ' HD13 ' B' ' 34' ' ' LEU . 4.6 mt-30 -64.3 -19.32 65.34 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -94.29 27.29 2.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.179 0.514 . . . . 0.0 109.647 176.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.688 ' CD1' ' CE1' ' A' ' 36' ' ' HIS . 7.9 t80 -103.16 156.02 18.0 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.494 -178.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.419 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.06 0 C-N-CA 124.449 1.1 . . . . 0.0 112.334 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.618 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 3.6 ttt85 . . . . . 0 N--CA 1.486 1.353 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -78.26 124.79 28.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.436 HD22 HD22 ' B' ' 12' ' ' LEU . 2.0 tp -138.61 141.03 39.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.308 -178.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.655 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -106.3 136.53 45.86 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 178.286 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.889 HD12 HG21 ' B' ' 30' ' ' ILE . 4.9 pt -146.95 175.5 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -177.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.597 ' C ' HD22 ' A' ' 7' ' ' LEU . 75.0 t-105 -98.78 109.17 21.97 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -177.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.869 HD11 ' CG2' ' B' ' 30' ' ' ILE . 0.9 OUTLIER -131.26 117.18 18.63 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.556 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 14.9 p -82.86 178.02 8.37 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 121.783 0.802 . . . . 0.0 111.969 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -53.88 -50.43 66.32 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.962 -1.472 . . . . 0.0 111.788 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.3 -35.9 3.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.229 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.847 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -101.01 -15.97 17.29 Favored 'General case' 0 C--N 1.339 0.125 0 N-CA-C 114.91 1.448 . . . . 0.0 114.91 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 8' ' ' SER . 78.8 mt -69.58 -38.96 77.57 Favored 'General case' 0 CA--C 1.51 -0.583 0 N-CA-C 105.474 -2.047 . . . . 0.0 105.474 175.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -61.16 -41.09 96.14 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 113.226 -1.806 . . . . 0.0 107.502 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.847 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -53.58 -48.42 69.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.028 178.075 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.044 HD21 HD13 ' B' ' 34' ' ' LEU . 19.2 mt -80.41 16.07 1.43 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.478 -0.783 . . . . 0.0 113.099 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.563 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -100.41 -44.69 5.82 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.632 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.563 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 7.2 mttm -88.75 -38.74 14.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.703 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.549 ' CE ' HD23 ' A' ' 15' ' ' LEU . 46.8 mtm -66.28 -70.6 0.23 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.497 179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.856 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -27.7 -32.1 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 125.081 1.352 . . . . 0.0 114.161 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.469 ' N ' ' O ' ' A' ' 18' ' ' MET . 1.5 mtt-85 -66.14 -120.71 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.08 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -23.3 12.51 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.924 -0.485 . . . . 0.0 111.673 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 17.0 mt-10 -108.37 -7.08 15.95 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 115.632 1.716 . . . . 0.0 115.632 -177.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.856 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -143.46 18.49 2.26 Favored Glycine 0 CA--C 1.504 -0.621 0 C-N-CA 116.075 -2.964 . . . . 0.0 117.262 -176.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.689 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER 53.46 -159.52 0.14 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 119.54 1.67 . . . . 0.0 113.0 175.781 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.463 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 14.8 p -66.22 158.92 27.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.635 -1.166 . . . . 0.0 109.852 178.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -44.52 -38.73 4.35 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.9 m -79.51 -52.65 7.75 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 122.089 0.156 . . . . 0.0 111.072 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.603 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -57.26 -27.39 62.05 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.26 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.986 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -64.53 -47.83 77.38 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 122.973 1.368 . . . . 0.0 108.824 177.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.6 HG22 HD11 ' B' ' 7' ' ' LEU . 0.4 OUTLIER -75.57 -27.83 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.499 0 CA-C-N 112.671 -2.059 . . . . 0.0 114.268 -176.389 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.482 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -73.36 -52.01 15.35 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.812 0.815 . . . . 0.0 109.277 177.039 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -55.22 -40.18 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-N 113.75 -1.568 . . . . 0.0 111.077 -179.516 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.691 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.34 -40.42 49.11 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.61 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.862 HD22 ' SD ' ' B' ' 29' ' ' MET . 12.1 mt -74.92 -35.49 62.19 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.256 -177.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -74.41 -11.1 60.15 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.5 m80 -106.61 -46.86 3.89 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 117.089 -0.05 . . . . 0.0 110.967 177.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.696 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 12.0 t80 -41.65 147.68 0.18 Allowed 'General case' 0 CA--C 1.541 0.607 0 O-C-N 123.275 0.359 . . . . 0.0 111.836 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.523 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 6.0 tppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.073 -0.965 . . . . 0.0 111.171 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -95.33 105.81 17.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -121.45 142.87 49.61 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.957 -178.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.655 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -108.29 137.47 46.21 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 177.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.861 HD13 HD13 ' B' ' 7' ' ' LEU . 2.4 pp -151.59 167.88 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-O 121.179 0.514 . . . . 0.0 112.374 -178.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -83.63 94.48 8.11 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.925 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.861 HD13 HD13 ' B' ' 5' ' ' ILE . 0.9 OUTLIER -129.29 99.89 5.39 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.216 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.618 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 52.3 p -72.66 -135.86 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.353 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.19 -151.7 0.27 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.891 -0.141 . . . . 0.0 111.295 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . 0.412 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.9 tt0 33.92 43.62 0.07 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.502 0.721 . . . . 0.0 112.634 179.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.689 ' CA ' ' HB2' ' B' ' 14' ' ' ASP . 1.6 t -173.24 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.705 179.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.734 HD21 ' HB3' ' B' ' 7' ' ' LEU . 22.8 mt -76.55 -42.0 44.57 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.44 -41.21 40.58 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.483 -1.689 . . . . 0.0 108.293 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.689 ' HB2' ' CA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.28 -17.37 1.74 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.424 179.008 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.051 HD13 ' HB2' ' B' ' 18' ' ' MET . 0.2 OUTLIER -71.59 21.04 0.05 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -179.683 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -64.17 -56.8 12.2 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 122.251 -0.281 . . . . 0.0 111.155 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 4.6 mtpm? -91.83 -2.05 57.06 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 1.051 ' HB2' HD13 ' B' ' 15' ' ' LEU . 3.9 mtm -96.99 -32.79 11.83 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.91 ' HB2' HD12 ' B' ' 15' ' ' LEU . . . -99.33 -73.3 0.63 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.475 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 0.2 OUTLIER -55.97 -62.41 1.72 Allowed 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.556 0.694 . . . . 0.0 111.47 -179.371 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.667 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.01 -28.0 3.63 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.708 179.492 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.943 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -87.97 -30.72 19.82 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.014 179.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.97 -7.48 31.22 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.886 -0.673 . . . . 0.0 114.519 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.943 HD13 ' CG ' ' B' ' 22' ' ' GLU . 0.0 OUTLIER -93.9 -174.02 3.31 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.096 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 96.4 p -103.97 164.2 11.86 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.099 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.1 OUTLIER -45.58 -40.47 8.84 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.279 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.596 ' HB2' ' HB3' ' A' ' 6' ' ' TRP . 59.8 p -81.43 -50.5 9.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.421 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.7 mm-40 -59.29 -20.1 51.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.72 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.985 ' SD ' HD21 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -72.22 -39.85 68.23 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 122.629 1.204 . . . . 0.0 108.63 177.469 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.889 HG21 HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -77.88 -38.09 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.482 0 CA-C-N 112.636 -2.074 . . . . 0.0 113.262 -175.494 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.427 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -60.8 -44.56 96.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 122.671 1.224 . . . . 0.0 107.815 175.755 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.427 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -59.97 -44.94 95.72 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.372 0 CA-C-N 112.271 -2.24 . . . . 0.0 111.872 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.696 ' HA ' ' HB2' ' A' ' 37' ' ' TYR . . . -51.8 -33.63 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.294 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.044 HD13 HD21 ' A' ' 15' ' ' LEU . 15.6 mt -76.4 -32.96 58.84 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.442 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -79.41 -16.72 55.71 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -123.73 21.18 9.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 118.17 0.441 . . . . 0.0 111.324 176.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.57 131.57 37.91 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 178.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.452 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.722 178.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.816 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.167 0.508 . . . . 0.0 112.104 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -92.02 120.58 32.79 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.56 ' HB3' HD23 ' B' ' 7' ' ' LEU . 2.8 tp -117.45 142.26 47.35 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.919 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -130.53 125.61 34.72 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.12 -0.945 . . . . 0.0 108.93 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.763 HD11 HG21 ' B' ' 30' ' ' ILE . 2.1 pt -152.02 -178.92 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -178.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.476 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.5 t-105 -94.72 98.38 10.74 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -177.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.903 HD11 HG22 ' B' ' 30' ' ' ILE . 1.5 mm? -125.09 111.34 15.23 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.5 t -76.8 -125.07 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.582 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 8.9 t70 -95.9 -45.47 6.93 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 113.164 0.801 . . . . 0.0 113.164 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -68.43 45.41 0.04 OUTLIER 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.187 0.595 . . . . 0.0 112.005 -178.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.836 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.5 t -170.62 -42.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 31.4 mt -72.66 -39.82 66.81 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 176.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.582 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 0.2 OUTLIER -68.7 -39.58 80.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 CA-C-N 113.511 -1.677 . . . . 0.0 107.033 176.01 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.836 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -48.3 -37.93 17.64 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.097 -1.411 . . . . 0.0 109.203 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.036 HD21 HD13 ' B' ' 34' ' ' LEU . 42.4 mt -84.86 33.39 0.53 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.811 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -107.55 -58.03 2.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.03 -33.47 61.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.734 178.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.644 ' CE ' HD23 ' A' ' 15' ' ' LEU . 33.4 mtm -74.84 -67.42 0.64 Allowed 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.019 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.869 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -28.87 -31.57 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.857 1.263 . . . . 0.0 114.121 -178.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' A' ' 18' ' ' MET . 3.7 mtt-85 -66.78 -118.23 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.151 0 C-N-CA 119.815 -0.754 . . . . 0.0 110.086 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.58 -22.87 24.08 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 122.003 -0.435 . . . . 0.0 111.778 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.525 ' HG3' ' HD3' ' B' ' 38' ' ' LYS . 24.3 mm-40 -109.3 -5.8 15.74 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 115.487 1.662 . . . . 0.0 115.487 -177.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.869 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -144.49 16.96 2.05 Favored Glycine 0 C--O 1.221 -0.701 0 C-N-CA 116.274 -2.87 . . . . 0.0 117.183 -176.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.661 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER 53.04 -161.83 0.11 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 119.496 1.648 . . . . 0.0 113.38 175.925 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -59.89 166.73 2.52 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.97 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -57.63 -42.68 83.87 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.98 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 94.2 p -74.24 -46.11 43.71 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.711 0.291 . . . . 0.0 110.273 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.528 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.5 mt-10 -61.08 -35.23 76.43 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.777 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.96 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -62.4 -47.95 81.88 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 123.64 1.686 . . . . 0.0 108.687 177.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.039 HG21 HD13 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -67.86 -15.68 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.979 0 CA-C-N 112.876 -1.965 . . . . 0.0 112.876 -177.572 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -83.3 -46.49 12.56 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.002 176.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.817 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -60.59 -34.86 60.04 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.978 0 CA-C-O 121.596 0.712 . . . . 0.0 109.217 177.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.961 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.28 -46.76 0.55 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.814 -1.539 . . . . 0.0 111.057 178.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.031 HD13 HD21 ' B' ' 15' ' ' LEU . 6.3 mt -87.26 -29.72 21.45 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 114.962 -1.017 . . . . 0.0 112.184 -178.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -83.64 -15.65 48.14 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.961 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -114.64 -4.46 12.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 -179.499 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.698 ' CD2' ' HD3' ' A' ' 38' ' ' LYS . 4.4 t80 -69.03 157.42 36.83 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.698 ' HD3' ' CD2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.181 0 C-N-CA 124.752 1.221 . . . . 0.0 112.899 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.375 0.131 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -81.43 121.52 26.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.68 140.55 50.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.469 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.919 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.84 129.86 56.34 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.062 HD12 HD21 ' B' ' 7' ' ' LEU . 1.4 pp -156.6 174.41 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -178.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.515 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.8 t-105 -91.76 116.11 28.62 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 1.062 HD21 HD12 ' B' ' 5' ' ' ILE . 0.6 OUTLIER -129.03 127.91 42.56 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 177.184 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.922 ' C ' HD23 ' B' ' 12' ' ' LEU . 7.9 p -82.13 -178.33 6.98 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 121.831 0.825 . . . . 0.0 111.1 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . 0.448 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 11.2 t70 -58.36 -44.99 89.06 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 114.309 -1.314 . . . . 0.0 113.172 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -75.68 40.53 0.19 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.089 0.471 . . . . 0.0 111.939 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.725 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 10.7 t -173.6 -52.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.671 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.922 HD23 ' C ' ' B' ' 8' ' ' SER . 0.4 OUTLIER -61.18 -30.12 70.21 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.048 177.631 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.554 ' HG2' ' HG ' ' B' ' 12' ' ' LEU . 2.5 mm-40 -99.52 -36.07 9.67 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.974 -1.466 . . . . 0.0 109.584 177.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.725 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -42.91 -33.41 0.78 Allowed 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.881 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.031 HD21 HD13 ' A' ' 34' ' ' LEU . 49.1 mt -66.74 12.38 0.08 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -75.22 -52.47 10.83 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -93.76 -10.15 35.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.692 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.621 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 11.6 mtp -87.11 -21.28 26.11 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.682 0.277 . . . . 0.0 110.966 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.35 -67.93 0.82 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.826 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.516 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.8 mmm180 -58.93 -70.28 0.16 Allowed 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.57 -33.6 6.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.796 -179.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.621 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 3.8 mm-40 -82.2 -25.41 34.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.291 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 98.6 64.38 0.86 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.408 -0.901 . . . . 0.0 113.439 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.81 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER 179.21 178.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.209 0.528 . . . . 0.0 111.634 177.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . 0.551 ' N ' HD23 ' B' ' 24' ' ' LEU . 0.8 OUTLIER -105.2 169.08 8.65 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.71 -178.521 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.89 -41.3 11.17 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.7 p -78.09 -50.65 11.62 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.445 0.164 . . . . 0.0 110.986 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.568 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.1 mm-40 -65.52 -10.6 36.23 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.412 178.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.877 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.9 tpt -84.34 -48.45 9.69 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 122.689 1.233 . . . . 0.0 107.788 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.903 HG22 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -74.13 -34.91 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.95 0 CA-C-N 113.017 -1.901 . . . . 0.0 112.952 -177.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.436 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -65.91 -48.24 72.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 122.384 1.088 . . . . 0.0 109.032 177.386 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.449 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -58.73 -43.79 88.6 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.174 0 CA-C-N 112.865 -1.97 . . . . 0.0 111.671 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.869 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.32 -31.34 3.81 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.005 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.036 HD13 HD21 ' A' ' 15' ' ' LEU . 14.2 mt -91.86 -31.76 15.58 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -177.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -72.07 -15.03 62.01 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.26 0.837 . . . . 0.0 113.26 -178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -111.23 19.81 17.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.114 0.415 . . . . 0.0 111.397 177.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.495 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 58.6 t80 -114.75 165.61 12.63 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 120.962 0.41 . . . . 0.0 111.823 -179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.525 ' HD3' ' HG3' ' A' ' 22' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.162 0 C-N-CA 123.869 0.868 . . . . 0.0 112.603 178.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.582 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.473 0 CA-C-O 120.696 0.284 . . . . 0.0 111.695 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -74.41 126.6 31.06 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -125.35 137.7 54.05 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.684 -178.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.955 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -115.98 121.51 42.49 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.231 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.902 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -145.86 176.3 1.9 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -177.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.628 ' O ' HD13 ' A' ' 7' ' ' LEU . 68.6 t-105 -94.02 100.83 12.89 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -177.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.856 HD21 HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -128.78 111.47 13.15 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 177.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.572 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 10.0 p -82.37 -176.79 6.39 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 121.724 0.774 . . . . 0.0 112.487 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -50.56 -47.78 57.72 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.009 -1.45 . . . . 0.0 112.474 -179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -47.03 -31.2 3.11 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.909 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -109.97 -15.29 14.09 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.5 mt -73.83 -41.04 62.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 105.901 -1.888 . . . . 0.0 105.901 176.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.41 -39.12 93.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 113.333 -1.758 . . . . 0.0 107.996 175.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.909 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -52.08 -44.68 64.47 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.558 178.78 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.041 ' CD2' HD13 ' B' ' 34' ' ' LEU . 19.6 mt -76.82 13.7 0.98 Allowed 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.572 0.953 . . . . 0.0 113.572 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.3 mm-40 -98.9 -51.61 3.82 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 19.1 mttp -73.73 -26.1 60.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.211 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.67 ' CE ' HD23 ' A' ' 15' ' ' LEU . 58.8 mtm -81.71 -74.75 0.32 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.933 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.68 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.94 -43.42 3.1 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 122.908 0.483 . . . . 0.0 112.1 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.1 mmm180 -63.71 -69.7 0.26 Allowed 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -51.36 -34.32 33.49 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.879 179.643 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -82.9 -11.39 58.22 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.184 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.14 7.22 76.51 Favored Glycine 0 C--N 1.339 0.717 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.592 -178.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.68 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 94.9 mt -82.75 168.01 17.61 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.523 0.678 . . . . 0.0 111.305 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.6 p -108.71 164.61 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.973 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.519 ' HB3' HG21 ' B' ' 5' ' ' ILE . 2.4 mttm -46.24 -31.97 2.78 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.418 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.1 m -84.29 -59.23 2.45 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 122.178 0.191 . . . . 0.0 111.139 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.582 ' HB3' HD22 ' A' ' 24' ' ' LEU . 2.8 mm-40 -59.72 -12.64 7.48 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.159 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 1.037 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.0 tpt -82.29 -47.17 12.71 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 122.855 1.312 . . . . 0.0 107.746 177.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.918 HD11 HD11 ' B' ' 34' ' ' LEU . 0.6 OUTLIER -75.55 -32.01 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.968 0 CA-C-N 112.847 -1.978 . . . . 0.0 113.782 -177.818 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.542 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -69.45 -48.81 59.66 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.185 0.993 . . . . 0.0 109.345 178.011 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.424 ' N ' HD22 ' A' ' 31' ' ' ASN . 1.6 t -59.22 -42.93 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.145 -1.843 . . . . 0.0 110.911 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.802 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -44.73 -41.62 6.98 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.331 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.854 HD23 ' CB ' ' B' ' 33' ' ' ALA . 8.2 mt -74.87 -33.98 62.16 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.836 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -70.95 -14.7 62.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -137.44 30.34 2.64 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.711 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -77.57 133.52 38.46 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 178.664 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.563 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 120.724 0.297 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -91.61 116.38 28.83 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.482 ' HB3' HD23 ' A' ' 7' ' ' LEU . 4.9 tp -116.46 139.43 50.46 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.736 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.955 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -122.95 123.47 40.99 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.239 178.662 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.803 HD12 HD21 ' B' ' 7' ' ' LEU . 1.3 pt -149.33 179.92 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.616 ' O ' HD13 ' B' ' 7' ' ' LEU . 71.1 t-105 -93.15 89.47 6.47 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.803 HD21 HD12 ' B' ' 5' ' ' ILE . 1.3 mm? -128.57 100.22 5.67 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.582 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 53.2 p -57.11 170.94 0.41 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 122.119 0.962 . . . . 0.0 112.779 -177.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -64.55 -40.0 94.79 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.319 -178.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . 0.492 ' O ' ' HB2' ' B' ' 14' ' ' ASP . 3.5 mm-40 -66.53 9.56 0.17 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.679 ' HA ' ' HB3' ' B' ' 14' ' ' ASP . 3.0 t -145.72 19.17 1.48 Allowed 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.859 1.429 . . . . 0.0 114.859 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' B' ' 8' ' ' SER . 13.0 mt -107.79 -46.4 3.8 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 175.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -88.02 -26.6 22.51 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 114.492 -1.231 . . . . 0.0 108.946 176.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.679 ' HB3' ' HA ' ' B' ' 11' ' ' THR . 6.5 t70 -55.77 -6.43 0.21 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 113.654 -1.612 . . . . 0.0 113.165 -179.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.955 HD23 ' SD ' ' B' ' 29' ' ' MET . 0.0 OUTLIER -135.86 35.06 2.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 121.357 0.599 . . . . 0.0 111.407 179.222 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.462 ' HB2' ' HD2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -51.22 -31.5 20.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.721 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 9.3 mtpp -62.14 -24.7 67.32 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.078 0.466 . . . . 0.0 110.794 179.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.78 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 8.6 mtm -86.64 -25.05 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.052 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.611 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -100.3 -73.52 0.63 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.719 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.462 ' HD2' ' HB2' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -56.95 -65.05 0.68 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.163 0.506 . . . . 0.0 112.092 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 13.0 mmp_? -50.54 -27.53 6.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.38 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.862 ' HG2' HD12 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -91.65 -23.69 19.76 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.004 179.524 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.82 -5.55 34.76 Favored Glycine 0 C--N 1.34 0.75 0 C-N-CA 121.342 -0.456 . . . . 0.0 112.405 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.862 HD12 ' HG2' ' B' ' 22' ' ' GLU . 53.5 mt -80.59 178.52 8.29 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.664 0.745 . . . . 0.0 112.017 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . 0.412 ' O ' ' CB ' ' B' ' 29' ' ' MET . 3.7 t -120.15 179.9 4.14 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.723 178.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.82 -38.56 61.47 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.3 m -86.36 -51.31 6.31 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 121.91 0.084 . . . . 0.0 111.087 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.621 ' HB3' HD22 ' B' ' 24' ' ' LEU . 1.6 mm-40 -62.88 -9.3 9.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.413 178.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.955 ' SD ' HD23 ' B' ' 15' ' ' LEU . 4.9 tpt -79.93 -47.79 14.46 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 123.095 1.426 . . . . 0.0 107.685 177.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.902 HG21 HD11 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -79.37 -28.77 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.451 0 CA-C-N 112.213 -2.267 . . . . 0.0 114.191 -176.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.43 HD22 ' N ' ' B' ' 32' ' ' VAL . 0.2 OUTLIER -70.06 -49.38 51.73 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.214 1.007 . . . . 0.0 109.087 177.653 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.43 ' N ' HD22 ' B' ' 31' ' ' ASN . 2.0 t -56.94 -47.12 83.78 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.1 -1.864 . . . . 0.0 110.266 -179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.854 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -48.84 -37.1 18.47 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.225 178.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.041 HD13 ' CD2' ' A' ' 15' ' ' LEU . 12.9 mt -72.46 -34.87 68.04 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.058 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -79.09 -14.63 59.02 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -130.75 19.87 5.09 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 177.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.692 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -73.03 137.02 45.11 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 178.863 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.708 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 1.4 mmpt? . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.55 -0.738 . . . . 0.0 111.718 178.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.432 ' HG2' HD21 ' A' ' 3' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -78.29 121.53 24.54 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.3 mm? -126.43 141.65 51.81 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.3 OUTLIER -125.55 117.81 24.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 178.463 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.95 HD11 HG21 ' B' ' 30' ' ' ILE . 4.4 pt -147.33 175.56 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -177.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.6 t-105 -92.99 98.77 11.57 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 -177.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.927 HD21 HG13 ' A' ' 5' ' ' ILE . 0.8 OUTLIER -119.28 115.38 24.05 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.623 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 42.0 p -71.58 -134.94 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.425 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.4 t70 -101.21 -41.09 6.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -177.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -73.11 38.97 0.09 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.123 0.487 . . . . 0.0 111.914 -179.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.823 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.7 t -160.59 -43.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 179.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.676 HD21 ' HB2' ' A' ' 7' ' ' LEU . 53.8 mt -68.97 -41.04 78.47 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 175.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.65 -39.74 91.7 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 113.425 -1.716 . . . . 0.0 108.065 176.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.823 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t0 -48.0 -36.6 13.03 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 114.552 -1.203 . . . . 0.0 109.352 178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.091 HD21 HD13 ' B' ' 34' ' ' LEU . 43.0 mt -79.85 27.2 0.3 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.399 -0.819 . . . . 0.0 113.099 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -100.86 -59.08 1.76 Allowed 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mttp -79.61 -5.93 56.04 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.573 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.774 ' CE ' HD23 ' A' ' 15' ' ' LEU . 43.6 mtm -100.99 -66.05 0.93 Allowed 'General case' 0 C--N 1.341 0.228 0 CA-C-N 116.993 -0.094 . . . . 0.0 110.837 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.822 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -29.23 -32.08 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.388 1.075 . . . . 0.0 113.613 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.49 ' CG ' ' N ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -62.54 -139.85 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.733 177.852 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.49 ' N ' ' CG ' ' A' ' 20' ' ' ARG . 0.1 OUTLIER -41.29 -24.1 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.587 -0.695 . . . . 0.0 112.243 179.037 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 18' ' ' MET . 15.5 mm-40 -100.73 -13.0 18.67 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.822 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -142.09 17.22 2.54 Favored Glycine 0 C--O 1.223 -0.557 0 C-N-CA 116.759 -2.638 . . . . 0.0 116.973 -176.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.699 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.1 mp 52.79 -162.36 0.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 119.512 1.656 . . . . 0.0 112.996 176.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.467 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 1.7 p -61.4 161.09 9.8 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.509 -1.223 . . . . 0.0 109.714 178.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.87 -41.59 33.74 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 111.968 0.359 . . . . 0.0 111.968 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.78 ' HA ' HD12 ' B' ' 5' ' ' ILE . 91.7 p -76.47 -51.72 11.22 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.574 ' O ' HG22 ' A' ' 32' ' ' VAL . 6.3 mt-10 -54.89 -31.22 59.72 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.956 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.5 tpt -64.47 -49.93 69.48 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 123.416 1.579 . . . . 0.0 108.877 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.018 HG21 HD11 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -66.37 -19.39 25.6 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.801 0 CA-C-N 113.325 -1.761 . . . . 0.0 112.813 -177.703 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.457 ' OD1' HG21 ' B' ' 11' ' ' THR . 0.0 OUTLIER -79.27 -51.57 9.28 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 176.634 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.793 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -53.41 -36.17 26.47 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.972 0 CA-C-O 121.499 0.666 . . . . 0.0 109.906 178.371 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.839 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.85 -47.68 0.7 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 114.034 -1.439 . . . . 0.0 111.18 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.045 HD13 ' CD2' ' B' ' 15' ' ' LEU . 5.6 mt -83.92 -25.41 30.18 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 114.705 -1.134 . . . . 0.0 112.049 -178.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -87.92 -9.21 54.33 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.241 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.839 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -136.24 22.22 3.22 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -179.675 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.78 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -88.29 140.45 29.46 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.04 0.536 . . . . 0.0 110.702 179.195 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.569 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.065 -0.969 . . . . 0.0 111.458 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.591 0.234 . . . . 0.0 111.61 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -85.41 123.3 30.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.451 ' HA ' HD13 ' B' ' 3' ' ' LEU . 2.7 mm? -129.12 148.56 51.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.913 -178.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -133.77 121.43 21.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.781 179.176 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.018 HD11 HG21 ' A' ' 30' ' ' ILE . 5.0 pt -148.89 179.71 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.545 ' O ' HD13 ' B' ' 7' ' ' LEU . 75.2 t-105 -97.12 101.99 13.67 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 -177.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.855 HD21 HG13 ' B' ' 5' ' ' ILE . 0.7 OUTLIER -126.86 117.01 21.74 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.137 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 18.4 p -73.18 -149.15 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.015 0.436 . . . . 0.0 111.343 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . 0.459 ' O ' HG22 ' B' ' 11' ' ' THR . 16.7 m-20 -96.22 -150.2 0.32 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.238 -178.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . 0.412 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 0.9 OUTLIER 35.55 43.15 0.15 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.251 0.62 . . . . 0.0 112.437 179.531 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.747 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 4.1 t -172.43 -46.75 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.403 ' HA ' HD12 ' A' ' 34' ' ' LEU . 19.0 mt -74.19 -39.2 63.33 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 106.905 -1.517 . . . . 0.0 106.905 176.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -89.63 -36.13 15.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 113.281 -1.781 . . . . 0.0 109.871 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.747 ' HB2' ' N ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -47.67 -25.45 1.2 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.32 -179.089 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.045 ' CD2' HD13 ' A' ' 34' ' ' LEU . 4.2 pp -83.81 34.18 0.49 Allowed 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 30.3 mm-40 -53.76 -28.21 33.33 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 3.3 mmtp -97.53 -5.94 34.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.714 ' HB2' ' HB2' ' B' ' 15' ' ' LEU . 14.2 mtm -89.84 -80.43 0.31 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.838 0.29 . . . . 0.0 110.562 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.69 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -49.03 -44.42 41.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.783 0.433 . . . . 0.0 111.846 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.475 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 2.2 mmm180 -62.74 -68.81 0.3 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.959 0.409 . . . . 0.0 111.807 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -52.17 -32.6 36.72 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.981 179.488 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.535 ' HB3' ' HG ' ' B' ' 24' ' ' LEU . 21.4 mm-40 -84.9 -11.31 55.86 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.061 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.64 10.13 75.52 Favored Glycine 0 C--N 1.34 0.765 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.281 -177.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.69 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 92.4 mt -83.22 165.08 19.73 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.583 0.706 . . . . 0.0 111.58 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 72.6 p -107.26 164.71 11.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.141 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.13 -37.48 1.44 Allowed 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 3.4 t -82.42 -56.9 3.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.597 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.7 mm-40 -60.19 -14.22 16.35 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.887 0.375 . . . . 0.0 110.761 179.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.749 ' SD ' HD22 ' B' ' 15' ' ' LEU . 3.1 tpt -79.23 -46.39 17.93 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 122.831 1.3 . . . . 0.0 108.24 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.95 HG21 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -78.06 -31.34 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.104 0 CA-C-N 112.656 -2.066 . . . . 0.0 113.594 -177.26 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.422 HD22 ' N ' ' B' ' 32' ' ' VAL . 0.2 OUTLIER -68.67 -48.38 64.08 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.24 1.019 . . . . 0.0 109.331 177.768 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.422 ' N ' HD22 ' B' ' 31' ' ' ASN . 1.4 t -59.75 -43.0 90.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 CA-C-N 113.071 -1.877 . . . . 0.0 111.154 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.831 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -46.28 -34.43 4.46 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.723 -1.126 . . . . 0.0 112.114 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.091 HD13 HD21 ' A' ' 15' ' ' LEU . 13.5 mt -88.94 -28.48 20.24 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -74.8 -11.01 60.05 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 22.8 m80 -123.27 27.06 7.69 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.593 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 33.7 t80 -115.99 155.21 28.47 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 111.723 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.431 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.973 -1.013 . . . . 0.0 112.227 178.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.625 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.6 mpt_? . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.951 0.405 . . . . 0.0 111.735 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -107.71 109.23 20.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.56 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.441 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 2.2 tp -127.99 147.21 50.49 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.206 -178.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.755 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -108.84 138.21 45.54 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.544 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.844 ' CD1' HG21 ' B' ' 30' ' ' ILE . 2.1 pt -148.5 -179.9 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.546 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.0 t-105 -97.13 93.72 6.72 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -177.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.849 HD11 HG22 ' B' ' 30' ' ' ILE . 0.7 OUTLIER -125.78 103.67 7.93 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.566 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.1 p -74.38 -176.11 2.56 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.781 0.8 . . . . 0.0 112.439 -178.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -52.5 -49.03 65.58 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 113.993 -1.458 . . . . 0.0 112.689 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -46.05 -34.23 3.96 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.935 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -100.45 -22.38 15.05 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 8' ' ' SER . 59.9 mt -71.55 -39.89 70.36 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 176.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.89 -40.61 96.9 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 113.427 -1.715 . . . . 0.0 107.53 175.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.935 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.8 OUTLIER -51.17 -43.29 61.27 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.513 -1.221 . . . . 0.0 108.923 178.138 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.063 HD21 HD13 ' B' ' 34' ' ' LEU . 25.0 mt -86.42 26.43 1.07 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -106.25 -53.42 2.63 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 178.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -76.3 -39.62 53.7 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.369 178.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.504 ' HE3' ' SD ' ' A' ' 29' ' ' MET . 35.4 mtm -68.24 -71.77 0.2 Allowed 'General case' 0 C--N 1.341 0.227 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.655 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.843 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -28.08 -32.09 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.165 1.386 . . . . 0.0 114.302 -178.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.517 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 1.8 mmm180 -65.66 -121.92 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.398 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.52 -22.62 8.54 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.824 -0.547 . . . . 0.0 111.654 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -108.1 -7.68 16.02 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 115.582 1.697 . . . . 0.0 115.582 -177.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.843 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -144.18 19.62 2.11 Favored Glycine 0 CA--C 1.504 -0.617 0 C-N-CA 116.015 -2.993 . . . . 0.0 117.416 -176.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.684 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER 52.61 -160.06 0.12 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 119.576 1.688 . . . . 0.0 113.052 175.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.468 ' OG ' ' HB2' ' A' ' 28' ' ' GLU . 12.9 p -64.02 159.54 19.92 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.787 178.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.55 -38.84 6.81 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.763 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 22.3 m -81.51 -51.17 8.56 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 111.325 0.121 . . . . 0.0 111.325 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.539 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 4.4 mt-10 -56.56 -27.17 57.16 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 1.019 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.8 tpt -63.26 -47.69 81.33 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 122.951 1.357 . . . . 0.0 108.996 177.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.012 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -76.95 -36.74 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.599 0 CA-C-N 112.678 -2.055 . . . . 0.0 114.29 -176.456 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.425 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -63.5 -47.06 83.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 122.015 0.912 . . . . 0.0 108.927 178.04 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.65 -42.78 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.503 0 CA-C-N 113.431 -1.713 . . . . 0.0 110.795 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.76 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -52.59 -38.92 61.0 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.965 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.113 HD13 HD21 ' B' ' 15' ' ' LEU . 13.9 mt -73.98 -29.86 62.19 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.59 -178.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -18.6 54.82 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.965 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -107.0 -36.67 6.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 178.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.615 ' CE2' ' HB3' ' B' ' 18' ' ' MET . 2.7 t80 -29.06 134.05 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.259 0.623 . . . . 0.0 111.891 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.063 0 CA-C-O 117.853 -1.07 . . . . 0.0 112.892 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 86.9 m95 -82.4 108.99 16.25 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.0 tp -130.26 145.38 51.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.182 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.755 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.0 OUTLIER -103.6 139.61 38.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.552 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.012 HD12 HG21 ' A' ' 30' ' ' ILE . 3.5 pt -148.17 179.75 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.763 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.8 t-105 -98.66 100.36 11.58 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -177.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.773 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -133.22 114.04 13.36 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 177.378 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.625 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -94.85 -166.35 1.45 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.524 0.678 . . . . 0.0 112.347 -178.244 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -44.93 -63.61 0.88 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.729 -1.123 . . . . 0.0 112.871 -178.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -53.15 -27.23 20.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.664 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 70.0 p -91.08 -34.52 15.05 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -178.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' B' ' 8' ' ' SER . 56.2 mt -67.61 -37.96 83.27 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.95 -43.35 88.23 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 113.561 -1.654 . . . . 0.0 107.526 176.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.664 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -52.58 -44.02 65.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.406 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.113 HD21 HD13 ' A' ' 34' ' ' LEU . 16.5 mt -76.29 29.64 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -114.56 -57.5 2.26 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.42 -31.56 54.13 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.636 178.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.796 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 7.9 mtm -82.51 -16.15 49.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.866 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.75 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.73 -65.28 0.97 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.858 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mtp-105 -60.89 -65.91 0.62 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.127 0.489 . . . . 0.0 111.533 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.19 -29.87 6.17 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.863 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.82 ' CG ' HD13 ' B' ' 24' ' ' LEU . 0.0 OUTLIER -85.47 -35.31 21.3 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.631 179.525 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.455 ' N ' ' HG3' ' B' ' 22' ' ' GLU . . . 106.56 67.81 0.67 Allowed Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.919 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.82 HD13 ' CG ' ' B' ' 22' ' ' GLU . 0.0 OUTLIER -178.26 -177.34 0.57 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.272 0.558 . . . . 0.0 112.059 178.299 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . 0.419 ' N ' HD23 ' B' ' 24' ' ' LEU . 19.1 p -110.81 170.75 7.89 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.121 -179.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.432 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 2.8 mttm -40.88 -38.73 1.0 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -179.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 6' ' ' TRP . 1.5 p -79.05 -56.66 4.21 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 117.838 0.29 . . . . 0.0 111.612 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.684 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.1 mt-10 -61.55 -15.63 40.35 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 1.045 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.7 tpt -77.15 -48.28 18.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 122.743 1.259 . . . . 0.0 108.279 178.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.88 HD11 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.88 -31.75 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.164 0 CA-C-N 112.885 -1.962 . . . . 0.0 113.462 -177.358 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -68.41 -47.92 66.01 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 122.271 1.034 . . . . 0.0 108.871 177.449 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.429 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.7 t -57.98 -44.69 87.35 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.302 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.038 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.723 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -49.09 -30.52 6.58 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.033 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.063 HD13 HD21 ' A' ' 15' ' ' LEU . 15.5 mt -80.93 -35.66 32.07 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.996 -177.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -77.86 -11.62 59.91 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.2 m80 -125.19 18.81 8.32 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.651 0.262 . . . . 0.0 111.215 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 0.6 OUTLIER -77.42 132.59 38.57 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.767 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.695 ' HE2' ' HA ' ' B' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.058 -0.972 . . . . 0.0 111.605 178.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.695 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 N-CA-C 111.571 0.212 . . . . 0.0 111.571 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.493 ' C ' HD22 ' A' ' 3' ' ' LEU . 92.7 m95 -88.4 118.92 28.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.531 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.3 mm? -136.92 148.64 47.11 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.382 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.851 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -121.09 130.47 53.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 178.799 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.774 HD12 HD21 ' A' ' 7' ' ' LEU . 1.3 pt -147.79 -179.79 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.452 ' C ' HD22 ' A' ' 7' ' ' LEU . 69.3 t-105 -95.2 89.26 5.45 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.774 HD21 HD12 ' A' ' 5' ' ' ILE . 2.1 mm? -120.58 99.36 6.51 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.5 p -74.8 -141.04 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.208 -178.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.697 ' O ' HG22 ' A' ' 11' ' ' THR . 2.5 p-10 -79.58 -155.33 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.733 -179.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.439 ' O ' ' HB ' ' A' ' 11' ' ' THR . 2.2 tt0 36.82 43.85 0.31 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.279 0.632 . . . . 0.0 112.412 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.697 HG22 ' O ' ' A' ' 9' ' ' ASP . 11.8 t -174.96 -48.2 0.01 OUTLIER 'General case' 0 C--O 1.232 0.144 0 CA-C-N 115.096 -0.957 . . . . 0.0 112.152 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.627 HD11 ' O ' ' A' ' 7' ' ' LEU . 15.1 mt -78.23 -39.71 39.55 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 105.68 -1.97 . . . . 0.0 105.68 175.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -41.9 62.94 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 113.268 -1.787 . . . . 0.0 106.933 176.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.69 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -51.02 -27.3 7.53 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.017 -1.447 . . . . 0.0 109.569 178.231 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.248 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -76.64 31.34 0.13 Allowed 'General case' 0 N--CA 1.426 -1.643 0 C-N-CA 124.161 0.984 . . . . 0.0 113.044 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -74.65 -61.52 1.85 Allowed 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.288 -0.257 . . . . 0.0 111.535 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -98.11 7.2 46.65 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -178.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.825 ' HB2' HD13 ' A' ' 15' ' ' LEU . 23.2 mtm -88.18 -82.05 0.24 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.879 0.309 . . . . 0.0 111.617 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.83 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -23.87 -35.78 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 126.444 1.898 . . . . 0.0 114.286 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 18' ' ' MET . 5.0 mtt-85 -68.52 -117.97 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.087 179.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.9 -23.32 6.88 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 4.4 mt-10 -116.67 4.21 13.1 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -177.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.83 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -149.34 16.56 1.14 Allowed Glycine 0 CA--C 1.502 -0.729 0 C-N-CA 115.398 -3.286 . . . . 0.0 117.417 -177.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.571 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.1 mp 52.83 -158.54 0.14 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 119.792 1.796 . . . . 0.0 112.671 176.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -70.53 150.3 46.26 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.149 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -38.79 -39.43 0.51 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.451 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 m -81.12 -54.96 5.08 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 122.028 0.131 . . . . 0.0 110.734 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -55.32 -29.88 59.15 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 1.248 ' SD ' HD11 ' A' ' 15' ' ' LEU . 4.1 tpt -59.45 -47.49 85.3 Favored 'General case' 0 N--CA 1.44 -0.975 0 CA-C-O 123.028 1.394 . . . . 0.0 109.714 177.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.635 HD13 HD21 ' B' ' 34' ' ' LEU . 0.3 OUTLIER -75.77 -21.39 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.686 0 CA-C-N 112.257 -2.247 . . . . 0.0 113.779 -175.812 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.444 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.3 OUTLIER -78.18 -51.57 10.02 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.983 0.897 . . . . 0.0 109.985 177.164 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.444 ' N ' HD22 ' A' ' 31' ' ' ASN . 1.6 t -63.53 -34.98 70.86 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-N 113.705 -1.589 . . . . 0.0 111.155 -179.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.8 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -46.9 -61.45 1.86 Allowed 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.339 -1.301 . . . . 0.0 112.438 -179.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.907 HD22 ' N ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -74.71 -28.09 60.66 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 119.086 -1.046 . . . . 0.0 112.048 -176.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.907 ' N ' HD22 ' A' ' 34' ' ' LEU . 9.2 mt-30 -56.55 -24.4 46.71 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.435 179.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -125.48 31.53 5.53 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.411 0.624 . . . . 0.0 109.505 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.807 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -87.85 139.38 30.58 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.171 179.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.555 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.123 -0.941 . . . . 0.0 111.187 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 2.2 ttt-85 . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -73.97 128.08 34.57 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -133.29 140.47 47.47 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.517 -178.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.851 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -121.55 130.25 53.41 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.619 HD13 HD13 ' B' ' 7' ' ' LEU . 2.3 pp -150.9 165.0 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -85.48 103.6 14.5 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 114.837 -1.074 . . . . 0.0 111.761 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.619 HD13 HD13 ' B' ' 5' ' ' ILE . 1.1 tp -124.69 113.87 18.57 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.904 ' O ' HD23 ' B' ' 12' ' ' LEU . 12.5 p -77.03 -173.44 2.74 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-O 121.449 0.642 . . . . 0.0 110.74 -178.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -59.41 -155.77 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.562 -1.199 . . . . 0.0 112.528 -178.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . 0.517 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.7 tt0 37.45 39.84 0.19 Allowed 'General case' 0 C--N 1.344 0.349 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 178.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.696 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.2 t 177.61 -51.56 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.965 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.904 HD23 ' O ' ' B' ' 8' ' ' SER . 0.4 OUTLIER -70.64 -27.56 64.14 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.002 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -98.31 -43.41 6.96 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.415 -1.72 . . . . 0.0 107.66 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.696 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.7 m-20 -56.17 -16.4 5.18 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.201 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.83 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.1 OUTLIER -70.32 23.58 0.03 OUTLIER 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.84 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -87.61 -36.25 17.61 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 178.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 11.1 pttm -102.97 -1.92 28.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.819 ' SD ' HD22 ' B' ' 15' ' ' LEU . 53.3 mtp -91.45 -84.49 0.26 Allowed 'General case' 0 C--N 1.34 0.182 0 O-C-N 122.259 -0.276 . . . . 0.0 110.45 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.617 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -45.55 -45.28 13.41 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.343 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -69.18 0.24 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 120.966 0.412 . . . . 0.0 111.769 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -33.49 42.77 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.862 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -81.3 -12.18 59.13 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.916 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.29 85.58 Favored Glycine 0 C--N 1.34 0.786 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.569 -178.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.8 HD22 ' HB3' ' B' ' 28' ' ' GLU . 96.5 mt -85.04 174.89 9.38 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.736 0.779 . . . . 0.0 111.392 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 19.4 p -116.58 172.71 7.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.747 177.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.455 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -48.96 -34.2 12.49 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.617 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.477 ' HA ' HD12 ' A' ' 5' ' ' ILE . 4.6 p -86.56 -54.52 4.35 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.8 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.0 mt-10 -60.02 -11.17 5.21 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.452 0.168 . . . . 0.0 111.038 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.83 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.4 tpt -84.36 -46.98 11.18 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 122.532 1.158 . . . . 0.0 107.995 177.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.636 HG22 HD11 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -76.38 -29.76 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.139 0 CA-C-N 113.038 -1.892 . . . . 0.0 113.132 -177.359 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.473 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -71.49 -50.92 26.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 122.206 1.003 . . . . 0.0 109.088 177.371 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.439 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 2.0 t -54.82 -41.58 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.273 0 CA-C-N 113.164 -1.835 . . . . 0.0 110.16 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.891 ' HB2' ' HB3' ' A' ' 34' ' ' LEU . . . -43.36 -43.12 4.93 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 113.781 -1.554 . . . . 0.0 111.831 178.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.035 HD13 HD23 ' A' ' 15' ' ' LEU . 9.6 mt -79.27 -29.88 42.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.606 -0.724 . . . . 0.0 112.922 -177.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -78.56 -16.32 57.57 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -132.55 21.04 4.29 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.463 0.574 . . . . 0.0 112.293 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.543 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -74.79 139.03 43.01 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 178.178 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.47 ' HB2' ' CE1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.853 -0.594 . . . . 0.0 112.474 178.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.742 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.6 OUTLIER . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 121.146 0.498 . . . . 0.0 112.034 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -114.12 114.36 25.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 176.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.1 tp -129.14 138.42 51.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.429 -177.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.891 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -115.97 123.82 48.99 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.859 HG13 HD21 ' A' ' 7' ' ' LEU . 3.9 pt -145.85 178.84 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.521 0.564 . . . . 0.0 112.521 -177.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.559 ' O ' HD13 ' A' ' 7' ' ' LEU . 66.0 t-105 -90.91 98.33 11.71 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.859 HD21 HG13 ' A' ' 5' ' ' ILE . 0.9 OUTLIER -130.24 107.78 9.54 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 176.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.686 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 23.0 t -72.45 -129.95 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.49 0.181 . . . . 0.0 111.49 -178.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.773 ' O ' HG22 ' A' ' 11' ' ' THR . 0.8 OUTLIER -97.74 -154.8 0.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -178.614 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.43 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.0 OUTLIER 34.95 45.96 0.18 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 123.28 0.632 . . . . 0.0 111.885 179.434 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.773 HG22 ' O ' ' A' ' 9' ' ' ASP . 13.9 t -174.78 -48.37 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.706 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.708 HD22 HD13 ' B' ' 3' ' ' LEU . 28.4 mt -73.82 -42.5 60.82 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 176.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.07 -38.58 79.11 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 113.368 -1.742 . . . . 0.0 107.442 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.683 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 2.2 t0 -48.72 -33.8 10.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.014 -1.448 . . . . 0.0 110.198 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.039 HD21 HD13 ' B' ' 34' ' ' LEU . 54.1 mt -69.2 16.67 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -76.23 -61.61 1.89 Allowed 'General case' 0 C--N 1.329 -0.323 0 O-C-N 122.173 -0.329 . . . . 0.0 110.367 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -83.72 -17.57 40.85 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.927 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.745 ' CE ' HD23 ' A' ' 15' ' ' LEU . 10.8 mtm -83.01 -28.47 29.64 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.363 0.125 . . . . 0.0 111.294 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.874 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -98.04 -64.13 1.07 Allowed 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -55.45 -63.86 1.03 Allowed 'General case' 0 CA--C 1.512 -0.516 0 CA-C-O 120.83 0.347 . . . . 0.0 111.774 -178.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.62 -34.49 11.76 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.371 179.224 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -74.1 -28.26 61.27 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.673 179.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.93 -13.47 59.03 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.544 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.874 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -88.17 -174.27 4.59 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.778 0.323 . . . . 0.0 111.737 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 t -116.43 174.17 6.21 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.18 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.477 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -43.58 -38.63 3.07 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 112.932 0.715 . . . . 0.0 112.932 -179.179 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.689 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 1.5 m -76.96 -60.36 2.39 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 122.567 0.347 . . . . 0.0 111.458 -179.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.0 mt-10 -58.84 -17.53 24.64 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.995 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.7 tpt -75.94 -47.7 24.11 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 122.757 1.265 . . . . 0.0 108.471 177.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.802 HD13 HD21 ' B' ' 34' ' ' LEU . 0.5 OUTLIER -74.0 -35.72 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 112.7 -2.046 . . . . 0.0 113.214 -177.213 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.421 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.92 -45.85 76.65 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 122.003 0.906 . . . . 0.0 108.882 176.932 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.503 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.4 t -58.91 -41.32 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.575 0 CA-C-N 113.387 -1.733 . . . . 0.0 110.282 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.627 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -52.69 -38.27 60.33 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.99 178.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.581 HD12 ' HB ' ' B' ' 11' ' ' THR . 17.8 mt -71.66 -30.41 65.68 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.074 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -79.79 -17.19 53.99 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.387 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.56 24.4 4.75 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.71 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -77.51 125.09 28.78 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.72 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 4.4 mmmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.092 -0.956 . . . . 0.0 111.343 178.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.686 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -88.97 134.76 33.86 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.708 HD13 HD22 ' A' ' 12' ' ' LEU . 2.7 tp -129.34 142.51 50.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.606 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.891 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -125.85 127.5 46.16 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.368 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.462 ' C ' HD12 ' B' ' 5' ' ' ILE . 2.4 pp -154.37 169.56 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -178.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.689 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 66.5 t-105 -80.88 113.92 19.41 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.409 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 15.1 tp -144.96 102.26 3.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 -178.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.742 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 14.0 p -79.29 178.08 8.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -176.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . 0.425 ' HB2' ' NH2' ' A' ' 1' ' ' ARG . 9.3 t70 -51.74 -50.63 60.23 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 113.093 -1.867 . . . . 0.0 112.497 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -47.74 -27.82 2.17 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.657 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 22.2 p -100.32 -22.78 14.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' B' ' 8' ' ' SER . 31.2 mt -79.21 -42.3 26.33 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 178.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.498 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.0 mt-10 -62.04 -41.72 98.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.033 -1.439 . . . . 0.0 107.507 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.657 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.75 -45.4 58.83 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.325 -1.307 . . . . 0.0 109.699 178.171 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.041 HD13 ' HG2' ' B' ' 18' ' ' MET . 1.2 mm? -82.53 22.2 0.89 Allowed 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.655 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.2 OUTLIER -80.34 -47.93 13.74 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.819 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.655 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 24.3 mtpp -102.92 -10.81 18.7 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.837 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 1.041 ' HG2' HD13 ' B' ' 15' ' ' LEU . 0.1 OUTLIER -105.86 4.64 29.92 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.027 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.852 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -99.76 -15.22 18.54 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.883 -0.51 . . . . 0.0 112.367 178.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 -77.89 -97.9 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.61 -27.63 62.92 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.922 0.391 . . . . 0.0 110.59 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' B' ' 18' ' ' MET . 24.4 mm-40 -101.95 -21.12 14.58 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 1.028 ' C ' HD13 ' B' ' 24' ' ' LEU . . . -102.51 -20.59 11.73 Favored Glycine 0 N--CA 1.467 0.706 0 C-N-CA 119.907 -1.14 . . . . 0.0 113.09 -179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 1.028 HD13 ' C ' ' B' ' 23' ' ' GLY . 0.0 OUTLIER 44.84 27.96 0.31 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 179.146 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . 0.738 ' HB2' ' HB2' ' B' ' 28' ' ' GLU . 0.5 OUTLIER 132.1 142.06 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 127.659 2.384 . . . . 0.0 109.449 177.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -45.84 -50.8 13.85 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 117.676 0.216 . . . . 0.0 111.206 -178.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.546 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 73.4 p -81.43 -35.71 30.31 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.594 0.235 . . . . 0.0 110.869 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.881 ' HB3' ' CD2' ' B' ' 24' ' ' LEU . 13.4 mm-40 -61.72 -26.93 68.36 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.035 179.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 1.038 ' HE3' HD11 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -68.12 -38.18 81.96 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-O 122.534 1.159 . . . . 0.0 109.263 178.52 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.68 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -80.17 -30.66 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.5 0 CA-C-N 112.999 -1.909 . . . . 0.0 112.837 -175.363 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.42 -44.8 86.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.81 HG21 HD11 ' B' ' 24' ' ' LEU . 2.1 t -58.41 -48.34 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.375 0 CA-C-N 112.422 -2.172 . . . . 0.0 111.854 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.599 ' HB1' ' HB1' ' A' ' 33' ' ' ALA . . . -47.14 -40.57 15.94 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.557 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.039 HD13 HD21 ' A' ' 15' ' ' LEU . 12.3 mt -75.73 -32.11 59.89 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.157 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 11.8 mt-30 -78.47 -15.15 58.94 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 25.9 m80 -122.28 6.15 9.67 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.514 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 0.5 OUTLIER -64.7 139.31 58.75 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.688 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 123.396 0.678 . . . . 0.0 112.368 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 1.2 ttt-85 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -73.18 123.36 23.49 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 178.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.818 HD22 HD22 ' B' ' 12' ' ' LEU . 2.2 tp -131.01 149.32 52.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.791 -178.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.941 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -118.33 132.32 56.28 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.995 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.848 ' CD1' HG21 ' B' ' 30' ' ' ILE . 3.6 pt -147.53 176.54 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.642 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.2 t-105 -96.57 103.59 15.51 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -177.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.715 HD11 ' CG2' ' B' ' 30' ' ' ILE . 0.7 OUTLIER -131.86 113.63 13.7 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 177.636 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.689 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 12.6 p -79.17 -176.85 5.35 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.727 0.775 . . . . 0.0 112.707 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -47.16 -60.42 2.49 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.369 -1.287 . . . . 0.0 112.552 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -50.61 -25.88 4.7 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.575 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 23.6 p -94.21 -34.08 13.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 8' ' ' SER . 61.7 mt -65.43 -41.13 93.84 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -62.42 -43.95 97.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 113.846 -1.524 . . . . 0.0 108.508 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.575 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -55.23 -50.05 70.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.491 179.081 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.003 HD21 HD13 ' B' ' 34' ' ' LEU . 14.2 mt -75.07 17.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -178.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 10.3 mm-40 -115.31 -56.35 2.37 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.1 mttp -76.23 -31.64 58.48 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.042 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.738 ' HE2' ' CD2' ' A' ' 15' ' ' LEU . 0.7 OUTLIER -97.88 21.12 11.01 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 121.184 0.516 . . . . 0.0 111.425 179.661 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.686 ' HA ' HD21 ' A' ' 24' ' ' LEU . . . -110.97 -64.72 1.24 Allowed 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.472 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -54.38 -68.48 0.18 Allowed 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.162 0.506 . . . . 0.0 111.542 179.054 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -34.39 26.86 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.515 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 18' ' ' MET . 14.0 mm-40 -76.06 -27.36 57.22 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.938 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.419 ' O ' ' HB3' ' A' ' 24' ' ' LEU . . . 111.0 49.31 0.68 Allowed Glycine 0 C--N 1.34 0.758 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.29 179.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.716 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER 179.87 -175.88 0.3 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.567 0.699 . . . . 0.0 112.316 178.632 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.513 ' N ' HD23 ' A' ' 24' ' ' LEU . 3.3 t -117.65 -179.42 3.73 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.559 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -45.06 -38.2 4.78 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.506 ' O ' HD11 ' B' ' 7' ' ' LEU . 12.0 m -78.01 -62.57 1.63 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.716 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 4.4 mt-10 -59.99 -14.49 16.35 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.902 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.1 tpt -78.44 -47.12 18.16 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 123.791 1.758 . . . . 0.0 107.115 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.047 HG22 HD11 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -64.84 -20.81 28.15 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.69 0 CA-C-N 113.065 -1.879 . . . . 0.0 112.19 -179.131 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.47 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -79.39 -52.52 7.97 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.152 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.862 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -52.05 -33.21 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.848 0 CA-C-O 121.462 0.649 . . . . 0.0 110.395 178.525 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.88 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -36.2 -43.01 0.33 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 113.822 -1.535 . . . . 0.0 111.059 178.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.663 HD13 ' CD2' ' B' ' 15' ' ' LEU . 7.1 mt -84.63 -35.2 22.83 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.425 -179.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.422 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -69.16 -25.6 64.44 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.88 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 6.9 p-80 -101.15 -29.58 12.04 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.712 0.687 . . . . 0.0 112.474 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.649 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 9.1 t80 -50.68 144.07 8.67 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 117.917 -1.04 . . . . 0.0 112.251 178.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.689 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.733 0 CA-C-O 121.034 0.445 . . . . 0.0 111.809 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . 0.41 ' C ' HD22 ' B' ' 3' ' ' LEU . 85.7 m95 -110.06 116.29 31.29 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.137 177.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.522 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.2 mm? -131.9 150.66 52.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.258 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.941 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -117.17 132.78 56.57 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.579 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.709 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.3 pt -151.52 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.61 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.2 t-105 -94.89 97.02 9.7 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -177.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 1.047 HD11 HG22 ' A' ' 30' ' ' ILE . 2.2 mm? -130.38 108.09 9.73 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 177.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 27.5 t -67.96 -125.78 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -176.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' B' ' 11' ' ' THR . 14.4 t70 -101.1 -40.12 7.35 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -176.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 14.8 mp0 -72.34 39.69 0.08 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.706 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 6.5 t -162.19 -41.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.818 HD22 HD22 ' A' ' 3' ' ' LEU . 20.2 mt -74.37 -42.67 58.92 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 105.981 -1.859 . . . . 0.0 105.981 176.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.23 -37.78 72.0 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.567 -1.651 . . . . 0.0 108.151 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.706 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.2 t70 -45.38 -33.68 2.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.31 -1.314 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.083 HD22 ' CG ' ' B' ' 29' ' ' MET . 41.5 mt -82.47 27.51 0.5 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -97.71 -51.63 4.03 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -82.84 -17.29 44.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.506 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.488 ' HA ' ' HB2' ' B' ' 22' ' ' GLU . 14.3 mtm -92.23 -70.19 0.71 Allowed 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.866 -0.152 . . . . 0.0 111.314 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.82 ' HA ' ' HA3' ' B' ' 23' ' ' GLY . . . -28.68 -31.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.916 1.286 . . . . 0.0 114.358 -178.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.46 ' N ' ' O ' ' B' ' 18' ' ' MET . 9.0 mtp-105 -67.19 -121.71 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.918 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 tpp85 -52.46 -23.96 7.08 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.915 -0.491 . . . . 0.0 111.645 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.488 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 0.8 OUTLIER -108.08 -1.65 20.25 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -177.519 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.82 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -151.01 20.43 0.97 Allowed Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 115.623 -3.179 . . . . 0.0 117.912 -176.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.652 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.1 mp 50.26 -157.33 0.09 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 120.108 1.954 . . . . 0.0 113.254 175.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -64.57 162.65 15.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.681 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.44 -44.58 17.47 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.555 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 14.8 m -82.91 -47.91 11.28 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.165 0.061 . . . . 0.0 111.165 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.471 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 2.6 mt-10 -55.61 -28.31 54.51 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 1.083 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.9 tpt -63.61 -48.69 76.3 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.682 1.229 . . . . 0.0 109.537 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.848 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.3 OUTLIER -77.54 -30.32 16.93 Favored 'Isoleucine or valine' 0 N--CA 1.406 -2.668 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.877 -176.289 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.455 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -68.51 -48.12 65.2 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 122.063 0.935 . . . . 0.0 109.044 177.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.455 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.4 t -58.37 -43.85 87.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.384 0 CA-C-N 113.314 -1.766 . . . . 0.0 110.675 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.87 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -51.34 -32.75 26.68 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.783 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.003 HD13 HD21 ' A' ' 15' ' ' LEU . 11.2 mt -83.82 -28.99 27.67 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.889 -178.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -74.51 -16.24 60.84 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.278 0.474 . . . . 0.0 112.278 -179.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 17.9 m80 -123.05 42.22 3.26 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.788 0.328 . . . . 0.0 111.104 178.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.72 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.6 OUTLIER -58.14 133.13 55.33 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.423 0.63 . . . . 0.0 112.108 179.715 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.637 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 4.2 tptt . . . . . 0 C--O 1.249 1.072 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.675 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.531 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.795 0 CA-C-O 120.688 0.28 . . . . 0.0 111.718 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -95.19 110.77 22.69 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.417 ' HG ' ' N ' ' A' ' 4' ' ' CYS . 3.0 tp -123.39 145.54 48.69 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.513 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.963 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -117.32 134.99 54.17 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 1.039 ' CD1' HD21 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -157.15 177.68 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.145 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.57 ' O ' HD13 ' A' ' 7' ' ' LEU . 69.8 t-105 -91.34 101.04 13.73 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -176.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.039 HD21 ' CD1' ' A' ' 5' ' ' ILE . 0.4 OUTLIER -125.56 106.59 9.87 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.378 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.429 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.1 t -85.57 -137.0 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.921 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.82 -157.33 0.09 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.566 0.209 . . . . 0.0 111.566 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 35.05 43.96 0.12 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.34 0.656 . . . . 0.0 112.247 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.66 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -172.85 -51.21 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.598 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.453 ' N ' ' CG2' ' A' ' 11' ' ' THR . 16.5 mt -72.22 -40.58 67.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.115 -2.18 . . . . 0.0 105.115 175.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -74.98 -40.9 60.46 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.195 -1.82 . . . . 0.0 107.982 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.66 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.5 OUTLIER -51.44 -27.61 10.77 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 114.625 -1.171 . . . . 0.0 109.948 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.953 HD22 ' HE3' ' A' ' 18' ' ' MET . 0.2 OUTLIER -80.8 36.19 0.38 Allowed 'General case' 0 N--CA 1.427 -1.624 0 C-N-CA 124.286 1.035 . . . . 0.0 112.927 -179.684 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -79.79 -59.15 2.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.271 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -101.98 23.42 11.51 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.953 ' HE3' HD22 ' A' ' 15' ' ' LEU . 6.5 mtm -103.85 -86.25 0.45 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.186 -0.321 . . . . 0.0 110.922 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.73 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -45.75 -44.75 14.04 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.088 0.555 . . . . 0.0 111.507 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HD2' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -64.17 -68.98 0.31 Allowed 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 120.993 0.425 . . . . 0.0 111.664 -179.735 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.08 -32.02 33.05 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.213 179.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 18' ' ' MET . 22.2 mm-40 -85.48 -12.48 51.72 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.285 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.04 3.52 88.26 Favored Glycine 0 C--N 1.34 0.77 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.439 -177.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.73 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 99.2 mt -81.51 175.03 10.87 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.493 0.663 . . . . 0.0 111.025 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -120.81 167.79 12.13 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.334 177.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.403 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 2.4 mttm -43.19 -38.61 2.57 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.722 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.1 m -84.3 -54.76 4.57 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.5 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.3 mm-40 -62.09 -9.87 8.61 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.191 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.871 ' SD ' HD11 ' A' ' 15' ' ' LEU . 2.5 tpt -87.22 -46.98 9.23 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 122.616 1.198 . . . . 0.0 108.123 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.9 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.7 OUTLIER -75.56 -34.37 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.127 0 CA-C-N 112.948 -1.933 . . . . 0.0 112.773 -177.83 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.443 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -65.75 -48.08 73.07 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 122.327 1.06 . . . . 0.0 108.905 177.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.443 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 1.2 t -60.38 -40.81 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.325 0 CA-C-N 112.932 -1.94 . . . . 0.0 111.098 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.913 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -46.33 -43.98 16.41 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.731 -1.122 . . . . 0.0 111.885 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.825 HD21 ' HB2' ' B' ' 33' ' ' ALA . 10.5 mt -80.11 -29.41 38.99 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.809 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -66.78 -19.06 65.67 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.33 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -120.7 43.53 2.73 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.121 0.486 . . . . 0.0 109.908 177.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.607 ' HD1' ' CE1' ' B' ' 36' ' ' HIS . 70.3 t80 -80.74 161.39 24.59 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.777 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.716 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 5.3 mmpt? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.244 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.42 0.153 . . . . 0.0 111.283 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . 0.516 ' C ' HD22 ' B' ' 3' ' ' LEU . 91.9 m95 -86.12 121.56 28.9 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.516 HD22 ' C ' ' B' ' 2' ' ' TRP . 2.4 mm? -138.44 153.55 48.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.301 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.963 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -113.27 129.85 56.41 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.223 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.9 ' CD1' HG21 ' A' ' 30' ' ' ILE . 3.9 pt -141.38 173.74 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -177.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.722 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 71.4 t-105 -99.43 97.71 8.71 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.854 HD21 HG13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -125.3 105.63 9.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.561 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 8.7 p -79.41 -164.36 0.63 Allowed 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 121.607 0.717 . . . . 0.0 112.207 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . 0.415 ' O ' ' HG3' ' B' ' 13' ' ' GLU . 15.9 m-20 -64.47 -44.23 91.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.285 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -64.06 5.68 0.23 Allowed 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.723 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.2 p -125.2 -42.89 1.97 Allowed 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -179.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' B' ' 8' ' ' SER . 25.5 mt -68.86 -40.81 79.1 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 106.614 -1.624 . . . . 0.0 106.614 178.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 3.1 mt-10 -66.33 -40.27 89.78 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.612 -1.631 . . . . 0.0 108.144 176.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.723 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -50.09 -36.7 30.49 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 114.653 -1.158 . . . . 0.0 109.836 178.574 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.169 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.35 31.19 0.34 Allowed 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 115.171 -0.922 . . . . 0.0 113.298 -179.492 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.474 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 4.5 pt-20 -79.52 -46.41 17.44 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.416 ' N ' ' CG ' ' B' ' 16' ' ' GLU . 3.7 ptpp? -108.36 -4.8 17.1 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.663 ' HB2' HD13 ' B' ' 15' ' ' LEU . 22.1 mtp -83.89 -74.23 0.38 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 117.898 0.317 . . . . 0.0 111.812 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.977 ' HB2' HD12 ' B' ' 15' ' ' LEU . . . -26.61 -33.87 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.789 1.636 . . . . 0.0 114.015 -177.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' B' ' 18' ' ' MET . 8.7 mtp-105 -66.9 -114.13 0.0 OUTLIER 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.62 -0.832 . . . . 0.0 110.193 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -58.92 -21.35 57.66 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.576 ' HB2' ' HA ' ' B' ' 18' ' ' MET . 2.4 mt-10 -113.0 -5.86 13.77 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -176.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.775 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -143.92 16.55 2.17 Favored Glycine 0 CA--C 1.502 -0.72 0 C-N-CA 116.442 -2.79 . . . . 0.0 116.719 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.631 HD12 ' C ' ' B' ' 23' ' ' GLY . 1.2 mp 52.74 -162.51 0.09 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 119.271 1.536 . . . . 0.0 112.926 176.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.8 m -62.48 157.69 19.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.102 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -40.42 23.49 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 117.594 0.179 . . . . 0.0 111.149 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -77.55 -50.34 12.78 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.619 0.247 . . . . 0.0 110.558 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.482 ' HB3' ' CB ' ' B' ' 24' ' ' LEU . 0.8 OUTLIER -58.19 -30.91 66.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.278 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 1.169 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.3 tpt -63.4 -46.13 87.83 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-O 123.854 1.787 . . . . 0.0 108.752 177.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.952 HG22 HD11 ' A' ' 7' ' ' LEU . 0.4 OUTLIER -67.65 -15.96 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.151 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.998 -177.385 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -47.43 12.16 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.967 176.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.823 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.0 OUTLIER -57.79 -32.88 44.04 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.212 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.656 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 1.046 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -39.17 -43.91 1.13 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 113.899 -1.5 . . . . 0.0 110.884 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.941 HD13 ' CD2' ' A' ' 15' ' ' LEU . 8.8 mt -80.64 -31.05 36.62 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.437 -179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' B' ' 32' ' ' VAL . 4.3 mt-30 -87.14 -12.8 45.94 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 1.046 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -118.34 6.39 11.87 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 179.526 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.74 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -78.28 141.83 38.24 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.901 0.48 . . . . 0.0 110.468 179.547 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.461 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.903 -1.046 . . . . 0.0 112.039 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.531 ' HB3' ' O ' ' B' ' 7' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.491 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -72.4 124.35 24.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.895 HD22 HD22 ' B' ' 12' ' ' LEU . 1.4 tp -131.27 149.41 52.58 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.745 -178.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -117.95 128.47 54.83 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 177.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.933 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.6 pt -145.35 173.91 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -177.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.48 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 75.1 t-105 -98.83 108.99 21.82 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.73 HD11 HD12 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -124.94 121.38 34.3 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.709 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.854 ' C ' HD23 ' A' ' 12' ' ' LEU . 15.6 p -80.84 178.73 8.2 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-O 121.704 0.764 . . . . 0.0 110.885 -179.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -59.63 -43.26 93.9 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.932 -178.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -78.25 40.13 0.34 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 111.642 -179.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.729 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 10.3 t -174.75 -51.73 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.961 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.913 HD22 ' HB2' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -58.52 -30.41 67.04 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.33 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -92.88 -37.1 12.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.042 -1.436 . . . . 0.0 109.216 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.729 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.3 t70 -45.41 -35.32 3.59 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.517 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.033 HD21 HD13 ' B' ' 34' ' ' LEU . 45.6 mt -58.12 -11.31 2.46 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.24 -61.51 1.98 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 21' ' ' ARG . 5.4 mmtm -63.65 -21.53 66.43 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.726 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.879 ' SD ' HD23 ' A' ' 15' ' ' LEU . 7.0 mtp -83.89 -76.42 0.29 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.01 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.704 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -41.89 -43.06 2.93 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.028 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 10.0 mtp85 -65.18 -70.3 0.24 Allowed 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 6.1 mmm180 -52.78 -31.74 40.11 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.134 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -83.91 -10.77 57.73 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.842 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.5 5.99 79.51 Favored Glycine 0 C--N 1.341 0.818 0 C-N-CA 120.431 -0.89 . . . . 0.0 111.701 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.704 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 97.8 mt -83.02 171.51 13.73 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.583 0.706 . . . . 0.0 111.248 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.4 m -114.84 166.73 11.45 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.664 -1.153 . . . . 0.0 109.425 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.64 -39.09 3.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 p -84.09 -52.92 5.9 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.482 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.5 mm-40 -62.48 -11.29 15.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.45 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.849 ' CG ' HD22 ' A' ' 15' ' ' LEU . 2.3 tpt -87.69 -48.28 7.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.41 1.576 . . . . 0.0 107.324 177.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.937 HG22 HD11 ' B' ' 7' ' ' LEU . 0.6 OUTLIER -68.08 -24.09 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.555 0 CA-C-N 113.571 -1.65 . . . . 0.0 112.143 -179.071 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.464 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -76.17 -46.4 28.7 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 177.155 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.837 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -57.43 -36.09 51.91 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.975 0 CA-C-O 121.57 0.7 . . . . 0.0 109.658 178.397 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.912 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -37.04 -47.27 0.72 Allowed 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.862 -1.517 . . . . 0.0 111.193 178.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.073 HD13 HD21 ' B' ' 15' ' ' LEU . 7.8 mt -83.36 -28.86 28.68 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.967 -178.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -86.64 -10.56 53.57 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.912 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -128.96 15.94 6.28 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.649 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -81.89 142.51 32.43 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.118 0.567 . . . . 0.0 109.54 178.505 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.463 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.164 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.881 178.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.913 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 111.593 0.219 . . . . 0.0 111.593 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . 0.409 ' C ' HD22 ' B' ' 3' ' ' LEU . 95.6 m95 -87.83 116.73 26.19 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.53 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -132.34 155.82 47.72 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.549 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.936 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -122.23 130.66 53.39 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.569 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.764 ' CD1' HG21 ' A' ' 30' ' ' ILE . 1.4 pt -150.63 -178.27 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.476 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.7 t-105 -94.6 93.26 7.48 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 -177.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.937 HD11 HG22 ' A' ' 30' ' ' ILE . 1.6 mm? -125.12 110.76 14.52 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 25.7 t -68.35 -126.94 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -176.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -103.63 -41.04 6.07 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -72.35 41.42 0.09 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 122.847 0.459 . . . . 0.0 111.95 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.701 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 6.6 t -163.44 -43.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.895 HD22 HD22 ' A' ' 3' ' ' LEU . 22.8 mt -72.65 -41.65 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 176.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.43 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.1 mt-10 -74.23 -36.04 63.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 113.346 -1.752 . . . . 0.0 108.541 176.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.701 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 4.3 t70 -46.72 -36.45 7.19 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.496 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.073 HD21 HD13 ' A' ' 34' ' ' LEU . 47.5 mt -71.51 -2.75 17.9 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.43 ' HB3' ' O ' ' B' ' 13' ' ' GLU . 0.6 OUTLIER -72.3 -36.99 69.06 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -91.79 -9.68 42.66 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.426 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.701 ' HE2' ' HB3' ' A' ' 34' ' ' LEU . 6.6 mtm -100.42 -76.46 0.55 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.105 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.668 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -41.09 -44.36 2.45 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 122.595 0.358 . . . . 0.0 111.4 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.498 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 2.6 mmm180 -64.03 -68.57 0.34 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.028 0.442 . . . . 0.0 111.901 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -52.6 -29.68 27.21 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.252 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -90.55 -8.56 49.93 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.118 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.43 7.61 73.56 Favored Glycine 0 C--N 1.342 0.871 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.897 -178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.668 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.0 mt -85.67 172.88 10.53 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 121.525 0.679 . . . . 0.0 111.42 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -110.25 165.06 12.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.482 178.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.9 -41.97 12.07 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.48 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 74.6 m -84.84 -48.19 9.6 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.717 0.266 . . . . 0.0 111.717 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -64.81 -10.29 26.9 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.596 0.236 . . . . 0.0 111.223 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 1.072 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.8 tpt -85.89 -47.51 9.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 177.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.933 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -73.54 -35.15 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.065 0 CA-C-N 113.092 -1.867 . . . . 0.0 113.151 -178.527 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.422 HD22 ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -65.67 -47.2 76.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.384 1.088 . . . . 0.0 109.165 177.811 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.422 ' N ' HD22 ' B' ' 31' ' ' ASN . 1.5 t -59.49 -45.23 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.367 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.051 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.885 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.61 -37.2 12.09 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.764 179.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.033 HD13 HD21 ' A' ' 15' ' ' LEU . 10.9 mt -81.43 -27.86 34.51 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -81.28 -13.67 58.21 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -178.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -117.46 29.67 7.74 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 118.002 0.365 . . . . 0.0 111.865 178.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.525 ' CE1' ' CD2' ' A' ' 36' ' ' HIS . 24.0 t80 -124.16 157.55 34.45 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.792 0.329 . . . . 0.0 111.649 -179.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.464 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.016 -0.992 . . . . 0.0 112.164 178.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 120.367 0.127 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 92.1 m95 -82.83 120.89 26.22 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.5 mm? -131.18 151.39 51.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.625 -178.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.928 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -128.59 123.86 34.42 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.501 178.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.954 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.0 pt -146.76 176.18 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -178.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.623 ' O ' HD13 ' A' ' 7' ' ' LEU . 72.9 t-105 -95.65 102.46 14.26 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -177.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.829 HD11 HG22 ' B' ' 30' ' ' ILE . 0.9 OUTLIER -129.63 112.08 13.33 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 177.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.571 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 11.2 p -79.65 -178.27 6.28 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.895 0.855 . . . . 0.0 112.697 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -49.6 -56.43 10.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.8 -1.546 . . . . 0.0 113.036 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -44.96 -33.81 2.16 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.912 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 4.7 t -96.87 -22.23 17.02 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 8' ' ' SER . 66.2 mt -73.66 -39.9 64.11 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 175.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.72 -40.17 96.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 113.386 -1.733 . . . . 0.0 107.452 175.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.912 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t0 -50.42 -45.49 55.8 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.466 177.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.941 HD21 HD13 ' B' ' 34' ' ' LEU . 19.3 mt -89.75 30.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.833 179.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.571 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -113.53 -50.36 2.85 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 110.31 -0.256 . . . . 0.0 110.31 179.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.571 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 53.6 mttm -88.66 -29.92 19.55 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.145 179.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.513 ' O ' ' HA3' ' A' ' 23' ' ' GLY . 1.1 ptt? -99.13 15.94 24.34 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.682 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.879 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -99.57 -18.73 17.22 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.1 mtp85 -67.29 -127.1 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.831 0 O-C-N 121.428 -0.795 . . . . 0.0 110.107 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.511 ' HA ' ' NE ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -52.96 -22.0 5.09 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 121.747 -0.596 . . . . 0.0 110.546 178.718 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -94.25 -21.48 19.01 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.879 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -138.54 16.47 3.34 Favored Glycine 0 CA--C 1.504 -0.609 0 C-N-CA 117.36 -2.352 . . . . 0.0 116.261 -177.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.72 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER 53.93 -167.4 0.07 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.645 1.222 . . . . 0.0 114.214 175.837 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -55.81 152.86 9.14 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.002 -1.454 . . . . 0.0 110.602 179.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -41.79 2.95 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 120.571 0.224 . . . . 0.0 111.208 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.613 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.1 m -76.64 -51.38 11.67 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.568 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 2.4 mt-10 -54.53 -35.74 63.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.693 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.901 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.6 tpt -59.36 -45.58 91.01 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 123.802 1.763 . . . . 0.0 108.845 177.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.002 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -66.36 -20.79 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.711 0 CA-C-N 112.953 -1.931 . . . . 0.0 112.713 -177.998 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.552 ' HB2' HD12 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -80.39 -47.76 13.93 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 177.348 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.83 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -58.74 -32.08 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.095 0 CA-C-O 121.681 0.753 . . . . 0.0 109.138 178.468 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 1.055 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.1 -47.15 1.51 Allowed 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 113.741 -1.572 . . . . 0.0 111.225 178.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.093 HD13 HD21 ' B' ' 15' ' ' LEU . 9.3 mt -81.53 -25.02 36.26 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.74 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.433 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -91.78 -8.62 46.24 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 1.055 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -125.78 16.31 8.06 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 122.732 0.413 . . . . 0.0 111.965 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.778 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.1 OUTLIER -87.9 137.53 32.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.118 0.567 . . . . 0.0 111.686 -179.194 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.581 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.601 -0.714 . . . . 0.0 111.324 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.676 0 N-CA-C 111.312 0.116 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -81.43 120.48 25.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' B' ' 3' ' ' LEU . 2.8 mm? -128.45 145.17 51.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.659 -178.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.928 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -124.4 123.16 39.56 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.484 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.897 ' CD1' HG21 ' A' ' 30' ' ' ILE . 2.6 pt -147.76 -179.35 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.614 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.1 t-105 -98.98 102.51 14.26 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 114.271 1.212 . . . . 0.0 114.271 -176.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 1.002 HD11 HG22 ' A' ' 30' ' ' ILE . 1.8 mm? -129.44 109.56 11.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 13.2 t -78.23 -132.5 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . 0.86 ' O ' HG22 ' B' ' 11' ' ' THR . 0.8 OUTLIER -90.7 -155.52 0.39 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.575 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . 0.457 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.8 mm-40 37.73 45.71 0.67 Allowed 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.579 0.751 . . . . 0.0 112.637 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.86 HG22 ' O ' ' B' ' 9' ' ' ASP . 9.3 t -179.17 -47.53 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.936 178.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.495 HD11 ' O ' ' B' ' 7' ' ' LEU . 38.4 mt -69.17 -40.3 78.21 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -68.98 -39.12 79.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 113.245 -1.798 . . . . 0.0 108.275 176.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.732 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 3.2 t70 -47.96 -33.67 8.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.391 -1.277 . . . . 0.0 110.539 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.093 HD21 HD13 ' A' ' 34' ' ' LEU . 57.9 mt -64.68 -5.3 5.43 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.47 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 14.5 mt-10 -62.4 -55.87 23.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.228 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.3 pttm -79.78 1.11 27.98 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.154 179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 1.013 ' HE2' HD23 ' B' ' 15' ' ' LEU . 12.0 mtm -107.43 -83.11 0.54 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 111.609 0.226 . . . . 0.0 111.609 -179.154 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.744 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -43.53 -43.61 5.6 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 16.6 mtp85 -70.2 -66.0 0.65 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 120.976 0.417 . . . . 0.0 111.461 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.26 -32.45 37.27 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.283 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' B' ' 18' ' ' MET . 21.9 mm-40 -88.44 -10.54 48.8 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.295 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.86 7.3 80.69 Favored Glycine 0 C--N 1.339 0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.502 -178.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.744 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 96.2 mt -80.27 171.51 14.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.578 0.704 . . . . 0.0 111.408 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.9 m -112.19 165.0 12.54 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.404 178.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.6 -40.0 5.43 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.0 m -83.32 -52.23 6.74 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.428 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.2 mt-10 -63.79 -11.04 23.36 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.756 -0.202 . . . . 0.0 110.958 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.983 ' CG ' HD22 ' B' ' 15' ' ' LEU . 3.0 tpt -85.16 -47.05 10.51 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 122.742 1.258 . . . . 0.0 107.704 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.954 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.6 OUTLIER -75.13 -32.59 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.04 0 CA-C-N 112.889 -1.959 . . . . 0.0 113.216 -178.008 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.466 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -70.32 -50.45 39.07 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.121 0.962 . . . . 0.0 109.449 178.181 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.466 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -55.97 -42.9 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.383 0 CA-C-N 113.219 -1.809 . . . . 0.0 110.264 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.941 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -49.44 -30.88 8.72 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.288 -1.323 . . . . 0.0 112.232 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.941 HD13 HD21 ' A' ' 15' ' ' LEU . 10.8 mt -89.66 -32.88 16.85 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -177.202 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -72.12 -13.45 61.57 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.595 0.221 . . . . 0.0 111.595 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -116.52 40.84 2.8 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.632 ' HD1' ' CE1' ' A' ' 36' ' ' HIS . 63.0 t80 -83.5 163.73 20.28 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.9 -178.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.563 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.282 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.846 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.063 0.459 . . . . 0.0 111.757 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -105.01 113.79 27.6 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.4 tp -122.71 142.57 50.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.944 -178.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.841 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.4 OUTLIER -123.68 129.58 51.34 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.121 178.486 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.76 HD11 HG21 ' B' ' 30' ' ' ILE . 2.1 pt -148.67 179.22 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -178.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.422 ' O ' ' HB3' ' B' ' 27' ' ' SER . 71.1 t-105 -96.2 90.41 5.48 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.736 HD21 ' CD1' ' A' ' 5' ' ' ILE . 1.9 mm? -119.16 101.26 7.87 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.46 ' HA ' ' HB2' ' B' ' 1' ' ' ARG . 51.6 p -74.76 -135.2 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.187 -178.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.44 -156.68 0.1 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.817 -0.174 . . . . 0.0 111.338 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? 34.32 43.68 0.09 Allowed 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 123.355 0.662 . . . . 0.0 112.465 179.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.704 ' CA ' ' HB2' ' A' ' 14' ' ' ASP . 1.2 t -172.19 -48.88 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.932 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.512 HD11 ' O ' ' A' ' 7' ' ' LEU . 15.3 mt -75.85 -41.25 52.96 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -77.17 -39.99 46.97 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.317 176.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.704 ' HB2' ' CA ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -51.05 -24.75 4.09 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.078 178.549 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.199 HD11 ' SD ' ' A' ' 29' ' ' MET . 0.1 OUTLIER -77.45 41.96 0.33 Allowed 'General case' 0 N--CA 1.424 -1.767 0 C-N-CA 124.24 1.016 . . . . 0.0 112.637 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.687 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -91.15 -47.91 7.26 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.342 179.926 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.687 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 5.3 mtpm? -102.88 24.8 10.14 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.638 ' HB2' HD13 ' A' ' 15' ' ' LEU . 16.6 mtp -116.51 -86.05 0.62 Allowed 'General case' 0 C--O 1.223 -0.34 0 O-C-N 122.172 -0.33 . . . . 0.0 111.201 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.708 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -42.0 -45.43 3.85 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.133 0.573 . . . . 0.0 111.188 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HD2' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -65.79 -67.18 0.46 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.147 0.498 . . . . 0.0 111.476 179.78 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.59 -32.76 29.86 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.154 179.332 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -86.18 -12.94 48.47 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.299 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.1 4.64 88.93 Favored Glycine 0 C--N 1.339 0.723 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.628 -178.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.708 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 98.4 mt -82.01 171.74 14.05 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 121.579 0.704 . . . . 0.0 111.36 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -116.96 168.6 10.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.667 -1.151 . . . . 0.0 109.371 177.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.437 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -45.41 -37.89 5.5 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -179.066 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.437 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 58.8 m -80.39 -57.39 3.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.442 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HB3' HD22 ' A' ' 24' ' ' LEU . 1.8 mm-40 -60.75 -16.21 37.68 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.137 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 1.199 ' SD ' HD11 ' A' ' 15' ' ' LEU . 2.4 tpt -82.15 -45.61 14.92 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-O 123.704 1.716 . . . . 0.0 107.853 177.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.807 HG21 HG12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -66.2 -19.48 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.399 -2.99 0 CA-C-N 113.355 -1.748 . . . . 0.0 111.615 -178.326 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.439 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -78.1 -53.29 7.54 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.91 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -51.69 -32.51 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.711 0 CA-C-O 121.584 0.707 . . . . 0.0 109.548 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.953 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -40.05 -43.39 1.57 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.93 -1.486 . . . . 0.0 111.064 177.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.897 HD22 HD21 ' B' ' 15' ' ' LEU . 6.8 mt -80.67 -29.08 36.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.824 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' A' ' 32' ' ' VAL . 8.8 mt-30 -79.08 -30.69 44.03 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.953 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 10.0 p-80 -92.05 -35.67 13.8 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 119.049 0.841 . . . . 0.0 111.895 178.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.67 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 8.1 t80 -46.53 140.44 4.34 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.607 0.242 . . . . 0.0 111.179 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.468 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 117.972 -1.013 . . . . 0.0 112.108 178.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.46 ' HB2' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 120.384 0.135 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 89.3 m95 -82.32 119.45 24.14 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 tp -126.37 134.25 51.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.525 -178.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.841 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -112.25 131.01 55.73 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 178.032 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.807 HG12 HG21 ' A' ' 30' ' ' ILE . 2.5 pp -153.73 169.98 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.581 ' O ' HD12 ' B' ' 7' ' ' LEU . 73.7 t-105 -89.04 100.44 13.22 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 -178.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.802 HD13 HD13 ' B' ' 5' ' ' ILE . 1.9 mp -135.17 114.66 12.56 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 176.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.846 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -91.93 -169.86 2.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -177.095 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -43.41 -60.09 1.86 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.126 -1.397 . . . . 0.0 112.869 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -47.58 -24.72 0.94 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.642 ' HB ' HD12 ' A' ' 34' ' ' LEU . 20.4 p -103.34 -27.41 12.47 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -177.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' B' ' 8' ' ' SER . 35.7 mt -74.22 -40.57 62.36 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 178.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -62.73 -41.04 98.98 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.701 -1.591 . . . . 0.0 108.34 176.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.616 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -48.91 -40.41 29.88 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.522 179.132 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.032 HD22 ' CG ' ' B' ' 29' ' ' MET . 26.3 mt -78.83 32.34 0.2 Allowed 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 44.9 mt-10 -103.1 -55.09 2.48 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.468 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 50.2 mttp -81.49 -25.15 36.25 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.433 179.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.837 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 9.5 mtm -86.2 -21.91 27.23 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.3 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.718 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.95 -68.4 0.83 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.828 179.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -57.8 -66.38 0.48 Allowed 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.011 0.434 . . . . 0.0 112.067 -179.599 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.468 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -49.53 -34.18 16.72 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.368 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.52 ' HB2' ' O ' ' B' ' 18' ' ' MET . 20.2 mm-40 -85.08 -10.7 56.59 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.931 -0.577 . . . . 0.0 112.243 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.03 -7.47 81.26 Favored Glycine 0 C--N 1.339 0.709 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.752 -178.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.718 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 73.8 mt -74.53 173.83 9.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.606 0.717 . . . . 0.0 111.596 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 53.3 p -119.05 166.01 13.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.582 178.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.67 -39.67 3.73 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.422 ' HB3' ' O ' ' A' ' 6' ' ' TRP . 1.4 m -84.14 -54.07 5.08 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 121.961 0.104 . . . . 0.0 111.19 -179.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -62.03 -8.79 5.8 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.648 0.261 . . . . 0.0 111.113 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 1.032 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.5 tpt -85.91 -47.96 9.16 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.76 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -75.63 -30.92 22.28 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.995 0 CA-C-N 113.003 -1.908 . . . . 0.0 113.283 -177.726 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.456 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -69.97 -49.83 47.84 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.263 1.03 . . . . 0.0 109.297 177.629 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.428 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.4 t -58.34 -43.13 85.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.143 -1.844 . . . . 0.0 111.082 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.736 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -46.23 -41.9 13.52 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.563 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.738 HD21 ' HB2' ' A' ' 33' ' ' ALA . 8.5 mt -80.25 -28.62 38.42 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.157 -178.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -70.62 -17.65 62.88 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 41.8 m80 -119.39 42.98 2.73 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.046 0.45 . . . . 0.0 110.903 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.633 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 69.6 t80 -55.95 172.63 0.18 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.645 179.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.429 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.155 0 C-N-CA 123.569 0.748 . . . . 0.0 111.961 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.655 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 120.93 0.395 . . . . 0.0 111.825 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 76.1 m95 -114.91 107.29 15.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.582 177.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.0 tp -122.15 140.67 52.27 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.294 -178.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -106.94 135.36 48.63 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.486 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.875 HD12 HD21 ' A' ' 7' ' ' LEU . 1.1 pt -151.65 -179.58 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.602 ' O ' HD13 ' A' ' 7' ' ' LEU . 73.3 t-105 -95.12 89.37 5.52 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.875 HD21 HD12 ' A' ' 5' ' ' ILE . 1.6 mm? -129.24 100.94 5.78 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.592 ' O ' HG22 ' A' ' 11' ' ' THR . 12.7 p -69.67 -171.55 0.4 Allowed 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 122.028 0.918 . . . . 0.0 112.651 -177.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.31 -39.16 82.16 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.209 -179.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.636 ' C ' ' HB2' ' A' ' 14' ' ' ASP . 31.2 mt-30 -75.63 42.19 0.22 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.679 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.676 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 1.3 t -169.3 -31.87 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.367 1.247 . . . . 0.0 114.367 178.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.85 HD22 HD22 ' B' ' 3' ' ' LEU . 16.7 mt -82.77 -43.08 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 177.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.9 -29.19 18.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 113.554 -1.657 . . . . 0.0 110.015 177.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.676 ' HB2' ' N ' ' A' ' 11' ' ' THR . 14.4 t70 -46.46 -13.58 0.02 OUTLIER 'General case' 0 C--O 1.233 0.198 0 CA-C-N 113.915 -1.493 . . . . 0.0 113.709 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.014 HD11 HD13 ' B' ' 34' ' ' LEU . 0.0 OUTLIER -140.14 46.45 1.84 Allowed 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 179.224 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 6.3 mt-10 -49.67 -28.61 6.13 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.979 178.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 21' ' ' ARG . 4.1 mtmp? -71.8 -48.12 48.67 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.989 ' HE3' ' HG ' ' A' ' 15' ' ' LEU . 16.0 mtm -59.08 -28.75 66.77 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.698 0.285 . . . . 0.0 111.331 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.77 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -98.79 -60.32 1.56 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.0 mtp85 -70.56 -68.07 0.45 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.515 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 13.2 mmp_? -50.23 -31.61 14.43 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.852 -179.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.59 ' HB2' ' O ' ' A' ' 18' ' ' MET . 19.6 mm-40 -85.5 -15.38 43.02 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.954 179.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.11 -1.95 85.08 Favored Glycine 0 C--N 1.339 0.749 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.783 -178.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.892 HD12 ' O ' ' A' ' 18' ' ' MET . 82.9 mt -73.97 178.4 4.98 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.686 0.755 . . . . 0.0 111.512 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' A' ' 29' ' ' MET . 52.2 p -117.43 165.47 13.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.025 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 17.9 mttm -47.7 -37.88 13.99 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.585 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 16.2 m -85.55 -50.81 6.94 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.16 -11.32 8.56 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.939 0.149 . . . . 0.0 111.055 179.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.829 ' HG2' HD21 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -84.27 -42.31 15.99 Favored 'General case' 0 CA--C 1.504 -0.824 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.029 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.772 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -77.28 -39.63 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.254 0 CA-C-N 112.901 -1.954 . . . . 0.0 113.269 -176.974 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.432 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -58.01 -46.2 85.65 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.325 1.059 . . . . 0.0 108.337 176.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.432 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -58.81 -43.48 88.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 112.797 -2.001 . . . . 0.0 111.062 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.804 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -60.46 -38.13 83.21 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.796 178.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.018 HD13 HD21 ' B' ' 15' ' ' LEU . 16.7 mt -70.3 -26.68 63.9 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.181 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.521 ' HG2' ' CE1' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -78.74 -30.19 45.67 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.129 -178.441 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.521 ' CE1' ' HG2' ' A' ' 35' ' ' GLN . 1.9 m80 -120.1 32.74 5.9 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.543 0.61 . . . . 0.0 111.375 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.576 ' HE2' ' HB3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -83.26 132.21 35.05 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 122.476 -0.14 . . . . 0.0 110.657 179.326 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.548 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 2.7 mppt? . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.423 -0.799 . . . . 0.0 111.483 177.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.526 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -78.81 116.63 19.27 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.85 HD22 HD22 ' A' ' 12' ' ' LEU . 1.7 tp -138.44 148.96 44.99 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.241 -178.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -107.04 134.93 49.44 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 178.399 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.828 ' CD1' HD21 ' B' ' 7' ' ' LEU . 4.3 pt -136.83 170.46 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -178.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.72 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.2 t-105 -97.11 102.33 14.08 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 -177.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.828 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.4 OUTLIER -131.81 113.16 13.16 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.662 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.655 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 15.7 p -76.18 -173.9 2.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 112.025 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -48.52 -62.12 1.66 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.352 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -50.85 -28.89 10.43 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.61 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 69.3 p -88.01 -32.63 18.72 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' B' ' 8' ' ' SER . 67.9 mt -68.64 -40.45 80.29 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 177.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -60.85 -42.72 98.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 113.538 -1.664 . . . . 0.0 107.771 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.639 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.5 OUTLIER -55.51 -46.74 76.95 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.092 178.589 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.028 HD22 ' CG ' ' B' ' 29' ' ' MET . 15.0 mt -73.24 25.89 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 43.5 mt-10 -111.49 -56.59 2.36 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.68 -29.57 61.28 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.845 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 21.4 mtm -82.99 -22.35 33.69 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.772 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.717 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.73 -69.06 0.78 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.558 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 1.4 mtp85 -55.53 -64.24 0.91 Allowed 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.33 -32.44 17.18 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.192 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' B' ' 18' ' ' MET . 3.8 mm-40 -89.68 -4.92 57.52 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.403 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.26 -11.02 61.83 Favored Glycine 0 C--N 1.34 0.768 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.953 -178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.717 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 74.8 mt -72.07 172.75 9.53 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.743 0.782 . . . . 0.0 111.685 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 89.8 p -119.87 164.28 16.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.253 178.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.418 ' HB3' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -43.55 -36.05 1.93 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.35 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.437 ' CB ' ' H ' ' A' ' 6' ' ' TRP . 1.4 m -83.51 -56.48 3.72 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 122.221 0.208 . . . . 0.0 111.363 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.471 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.3 mt-10 -62.48 -8.56 6.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.495 178.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 1.028 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.3 tpt -86.0 -48.59 8.53 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.754 HD11 HD11 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -73.08 -35.12 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.044 0 CA-C-N 112.966 -1.925 . . . . 0.0 112.976 -178.051 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.456 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -66.55 -49.41 66.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 122.021 0.915 . . . . 0.0 109.155 177.503 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -57.3 -42.33 80.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 113.393 -1.73 . . . . 0.0 111.932 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.806 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -48.86 -39.68 26.65 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.429 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.014 HD13 HD11 ' A' ' 15' ' ' LEU . 9.2 mt -76.65 -35.83 57.73 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.196 -177.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.93 -11.12 60.46 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -106.87 -50.53 3.09 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.947 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.615 ' CD2' ' SD ' ' A' ' 18' ' ' MET . 12.0 t80 -44.12 144.58 0.92 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.264 0.352 . . . . 0.0 110.9 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.47 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.012 -0.995 . . . . 0.0 112.14 178.172 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 120.933 0.397 . . . . 0.0 111.881 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.403 ' C ' HD22 ' A' ' 3' ' ' LEU . 98.4 m95 -89.02 122.83 32.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.044 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.497 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 3.2 mm? -130.08 153.8 48.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.896 -178.586 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' B' ' 3' ' ' LEU . 0.5 OUTLIER -127.76 129.72 47.54 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.409 178.898 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.825 HD12 HD21 ' A' ' 7' ' ' LEU . 1.3 pt -148.11 -179.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.694 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.574 ' C ' HD22 ' A' ' 7' ' ' LEU . 71.7 t-105 -95.06 91.32 6.29 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -177.264 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.825 HD21 HD12 ' A' ' 5' ' ' ILE . 1.8 mm? -127.46 104.05 7.69 Favored 'General case' 0 N--CA 1.462 0.157 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 177.451 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.674 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 8.4 t -75.5 -137.4 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 120.557 0.218 . . . . 0.0 110.916 -178.789 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.483 ' O ' HG22 ' A' ' 11' ' ' THR . 1.9 p-10 -84.27 -155.76 0.2 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.963 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.409 ' O ' ' HB ' ' A' ' 11' ' ' THR . 2.1 tt0 36.01 43.11 0.19 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.505 0.722 . . . . 0.0 112.675 178.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.727 ' N ' ' HB2' ' A' ' 14' ' ' ASP . 5.0 t -173.03 -45.38 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.725 178.681 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.644 HD11 ' O ' ' A' ' 7' ' ' LEU . 18.1 mt -78.37 -40.74 35.42 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 175.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -38.84 26.91 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 113.187 -1.824 . . . . 0.0 108.315 177.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.727 ' HB2' ' N ' ' A' ' 11' ' ' THR . 0.1 OUTLIER -48.97 -26.47 2.54 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 114.009 -1.451 . . . . 0.0 110.898 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.94 HD11 ' CE ' ' A' ' 18' ' ' MET . 0.4 OUTLIER -82.13 24.29 0.66 Allowed 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.475 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -66.14 -40.3 90.52 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 122.249 -0.282 . . . . 0.0 110.259 178.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.5 mtmm -105.78 -13.68 15.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.94 ' CE ' HD11 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -106.49 5.17 29.03 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 -179.015 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.923 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -98.76 -20.95 16.62 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 178.139 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.401 ' HB2' ' NH1' ' A' ' 20' ' ' ARG . 4.4 mtp-105 -70.42 -124.04 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 O-C-N 121.62 -0.675 . . . . 0.0 110.112 -179.332 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.2 -25.24 3.43 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.959 0.409 . . . . 0.0 110.843 179.09 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -95.64 -19.98 19.31 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -178.731 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.923 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -135.55 12.84 4.28 Favored Glycine 0 CA--C 1.504 -0.608 0 C-N-CA 117.145 -2.455 . . . . 0.0 116.489 -177.143 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.726 HD12 ' C ' ' A' ' 23' ' ' GLY . 0.6 OUTLIER 53.04 -162.91 0.1 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 118.916 1.358 . . . . 0.0 113.483 175.798 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.8 m -58.66 158.04 8.45 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.833 177.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.14 -40.76 5.21 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.231 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.4 ' CB ' ' H ' ' B' ' 6' ' ' TRP . 3.9 m -77.77 -49.67 13.91 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.482 0.182 . . . . 0.0 111.277 179.991 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.578 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 9.5 mt-10 -55.96 -33.58 64.91 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.353 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.856 ' SD ' ' HG ' ' A' ' 15' ' ' LEU . 5.4 tpt -59.95 -51.91 67.67 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-O 123.18 1.466 . . . . 0.0 108.848 177.686 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.882 HG21 HD13 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -69.39 -29.81 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.587 0 CA-C-N 112.938 -1.937 . . . . 0.0 113.974 -177.265 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.427 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -70.44 -49.46 48.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.198 0.999 . . . . 0.0 108.882 176.706 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.491 HG21 HD11 ' A' ' 24' ' ' LEU . 1.4 t -56.33 -42.26 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.307 0 CA-C-N 113.093 -1.867 . . . . 0.0 111.434 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.895 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -48.44 -43.33 34.29 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.106 179.169 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.027 HD13 ' CD2' ' B' ' 15' ' ' LEU . 11.7 mt -70.73 -29.7 66.02 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.943 -178.141 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -76.92 -23.27 52.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.812 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.435 ' HB3' ' HB2' ' B' ' 38' ' ' LYS . 37.0 m80 -118.87 7.83 11.61 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 178.816 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.665 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.4 OUTLIER -61.96 138.05 58.32 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.168 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 117.883 -1.056 . . . . 0.0 112.334 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.674 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 2.1 ttt85 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -72.45 125.07 26.5 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.549 HD22 HD22 ' A' ' 12' ' ' LEU . 2.4 tp -126.37 141.24 51.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.732 -178.479 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.498 ' O ' HG23 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -119.82 131.8 55.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.343 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.046 ' CD1' HD21 ' B' ' 7' ' ' LEU . 1.2 pp -157.19 173.05 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 121.05 0.452 . . . . 0.0 112.142 -178.434 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.646 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.8 t-105 -88.61 109.52 20.16 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -176.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 1.046 HD21 ' CD1' ' B' ' 5' ' ' ILE . 0.4 OUTLIER -130.91 122.02 26.22 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 177.085 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 33.7 t -78.03 -126.57 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -178.68 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . 0.514 ' O ' ' HB3' ' B' ' 13' ' ' GLU . 12.4 t70 -105.06 -44.05 4.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.195 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -73.42 39.82 0.1 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.118 0.485 . . . . 0.0 111.618 -179.412 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.744 ' OG1' HD12 ' A' ' 34' ' ' LEU . 5.1 t -159.5 -41.34 0.05 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 179.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.929 HD21 ' HB2' ' B' ' 7' ' ' LEU . 50.3 mt -72.96 -41.86 63.99 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 176.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' B' ' 9' ' ' ASP . 0.1 OUTLIER -73.37 -38.29 65.74 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.196 -1.82 . . . . 0.0 107.365 176.793 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.688 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 2.2 t70 -47.74 -36.89 12.18 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 113.743 -1.571 . . . . 0.0 110.45 179.066 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.027 ' CD2' HD13 ' A' ' 34' ' ' LEU . 45.7 mt -68.71 -10.92 59.23 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 113.901 1.074 . . . . 0.0 113.901 -179.592 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.35 -59.62 4.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.662 0.268 . . . . 0.0 110.927 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.57 -19.04 64.45 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.91 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.734 ' CE ' HD23 ' B' ' 15' ' ' LEU . 39.1 mtm -89.98 -77.01 0.41 Allowed 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.247 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.515 ' HA ' ' OE2' ' B' ' 22' ' ' GLU . . . -37.09 -41.52 0.37 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.138 0.575 . . . . 0.0 112.324 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -68.91 -71.02 0.24 Allowed 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.847 0.356 . . . . 0.0 111.497 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.07 -29.81 45.79 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.08 179.326 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.67 ' CD ' HD12 ' B' ' 24' ' ' LEU . 3.9 pt-20 -83.71 -15.72 47.62 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.482 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.52 12.02 84.69 Favored Glycine 0 C--N 1.344 1.008 0 C-N-CA 121.214 -0.517 . . . . 0.0 114.011 178.416 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.67 HD12 ' CD ' ' B' ' 22' ' ' GLU . 65.1 mt -102.35 175.18 5.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.553 0.692 . . . . 0.0 111.668 -179.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 68.5 p -106.3 164.56 11.92 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.904 -1.043 . . . . 0.0 109.749 178.502 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.05 -39.04 1.12 Allowed 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -179.352 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.526 ' O ' HD11 ' A' ' 7' ' ' LEU . 1.2 m -81.15 -59.44 2.65 Favored 'General case' 0 CA--C 1.521 -0.153 0 C-N-CA 122.028 0.131 . . . . 0.0 111.3 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -57.76 -14.87 6.5 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.726 0.298 . . . . 0.0 110.922 179.036 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.98 ' CG ' HD22 ' B' ' 15' ' ' LEU . 1.7 tpt -78.41 -46.28 20.26 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 122.73 1.252 . . . . 0.0 107.996 177.743 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.903 HD11 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -75.45 -29.7 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.109 0 CA-C-N 112.918 -1.946 . . . . 0.0 113.66 -177.605 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.528 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -70.26 -49.99 44.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 122.325 1.059 . . . . 0.0 109.009 177.329 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.432 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 1.9 t -56.71 -43.73 79.92 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 CA-C-N 112.958 -1.928 . . . . 0.0 110.967 -179.378 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.758 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -45.54 -39.34 7.34 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.341 179.072 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.895 HD23 ' CB ' ' A' ' 33' ' ' ALA . 8.8 mt -75.97 -32.25 59.4 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.167 -177.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -79.92 -11.41 59.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -125.49 36.96 4.46 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.255 0.55 . . . . 0.0 111.05 177.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.742 ' HD1' ' N ' ' B' ' 38' ' ' LYS . 0.2 OUTLIER -58.37 130.08 45.06 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.362 178.86 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.742 ' N ' ' HD1' ' B' ' 37' ' ' TYR . 7.1 mmpt? . . . . . 0 C--O 1.247 0.943 0 CA-C-O 118.94 -0.552 . . . . 0.0 111.58 176.051 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.779 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.803 0.335 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.446 ' O ' ' HD3' ' A' ' 1' ' ' ARG . 99.2 m95 -79.01 166.99 21.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.322 179.526 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.2 tp -176.76 145.49 0.52 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.099 -179.49 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.717 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.9 OUTLIER -102.27 140.42 36.58 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 178.616 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.955 ' CD1' HG21 ' B' ' 30' ' ' ILE . 4.4 pt -148.47 175.46 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -178.268 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.679 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 75.4 t-105 -101.15 105.75 16.93 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -177.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.772 HD21 HG13 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -127.2 120.28 28.4 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.728 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 t -82.36 -129.03 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 111.582 0.215 . . . . 0.0 111.582 -178.806 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -102.77 -40.96 6.35 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -178.536 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -73.89 41.69 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.232 0.539 . . . . 0.0 111.522 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.86 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 3.0 t -164.41 -44.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.347 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.645 HD21 ' HB2' ' A' ' 7' ' ' LEU . 84.3 mt -63.9 -40.37 96.34 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 176.407 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -64.32 -42.13 96.46 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 113.429 -1.714 . . . . 0.0 108.132 176.403 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.86 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.3 OUTLIER -51.38 -41.33 60.61 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.356 178.244 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.006 HD21 HD13 ' B' ' 34' ' ' LEU . 24.6 mt -83.96 32.72 0.48 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.98 179.789 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -107.57 -69.35 0.85 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? -76.99 -25.69 53.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.405 179.079 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.615 ' HE1' ' HB3' ' B' ' 34' ' ' LEU . 0.9 OUTLIER -94.52 8.02 43.6 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.54 179.796 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.882 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -100.29 -17.97 17.04 Favored 'General case' 0 C--O 1.214 -0.785 0 C-N-CA 122.954 0.502 . . . . 0.0 112.199 178.894 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -131.13 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.814 0 O-C-N 121.592 -0.693 . . . . 0.0 109.866 -179.899 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -23.54 1.85 Allowed 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 121.8 -0.563 . . . . 0.0 110.464 178.629 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -92.17 -23.79 19.28 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -178.563 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.882 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -137.07 17.2 3.62 Favored Glycine 0 CA--C 1.504 -0.638 0 C-N-CA 117.218 -2.42 . . . . 0.0 116.529 -177.336 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.704 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER 54.62 -166.45 0.09 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 118.799 1.3 . . . . 0.0 114.147 175.654 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.06 154.11 13.37 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.516 179.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -42.69 8.84 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-O 120.438 0.161 . . . . 0.0 111.209 -179.685 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.659 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 5.9 m -75.65 -44.63 41.58 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.919 179.26 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' ' CB ' ' A' ' 24' ' ' LEU . 0.9 OUTLIER -62.4 -37.32 85.31 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.509 179.513 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.959 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.3 tpt -57.99 -43.52 86.62 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 124.125 1.917 . . . . 0.0 108.36 177.058 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.086 HG21 HD12 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -68.61 -16.3 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.911 0 CA-C-N 112.583 -2.099 . . . . 0.0 112.949 -177.778 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -86.83 -45.13 11.17 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.821 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -59.0 -31.4 45.54 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.635 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 1.032 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -38.08 -46.84 1.06 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.319 177.951 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.893 HD13 ' CD2' ' B' ' 15' ' ' LEU . 8.1 mt -82.68 -26.56 31.98 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.653 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -87.84 -13.75 41.29 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -179.789 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 1.032 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -117.9 4.09 12.18 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 179.699 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.648 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.8 t80 -76.56 146.38 38.39 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.8 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 117.971 -1.014 . . . . 0.0 112.202 179.442 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -90.7 105.1 17.59 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.732 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.45 ' HG ' ' N ' ' B' ' 4' ' ' CYS . 1.9 tp -125.26 145.64 49.9 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.251 -177.77 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.717 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -103.27 136.91 42.17 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 177.627 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.086 HD12 HG21 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -149.53 -175.0 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.015 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.659 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 64.8 t-105 -92.62 91.0 7.35 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -177.396 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.975 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -125.2 95.08 4.36 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.601 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.779 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 51.2 p -64.73 177.82 0.88 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-O 121.761 0.791 . . . . 0.0 111.853 -178.377 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -54.19 -52.65 60.55 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.649 -179.744 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -55.68 -26.88 47.11 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -179.169 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.673 ' HB ' HD12 ' A' ' 34' ' ' LEU . 37.1 p -82.97 -30.29 28.38 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.286 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' B' ' 8' ' ' SER . 30.0 mt -73.77 -39.33 64.26 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 178.619 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' B' ' 16' ' ' GLU . 2.8 mt-10 -60.15 -41.29 92.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 113.719 -1.582 . . . . 0.0 107.612 175.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.51 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.2 OUTLIER -53.21 -39.91 64.07 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.192 -1.367 . . . . 0.0 110.537 178.603 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.061 HD22 ' CG ' ' B' ' 29' ' ' MET . 30.9 mt -77.75 28.4 0.17 Allowed 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -179.007 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.535 ' HG2' ' HG3' ' B' ' 17' ' ' LYS . 0.0 OUTLIER -101.01 -49.58 4.07 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.657 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.535 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 57.0 mttm -84.61 -20.81 30.81 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.58 179.25 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.888 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.6 mtm -91.93 -21.04 20.79 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.612 -179.745 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.698 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -102.66 -62.25 1.3 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.253 179.714 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 4.8 mtp-105 -62.21 -64.94 0.77 Allowed 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.962 0.41 . . . . 0.0 111.691 -179.487 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.58 -33.4 21.83 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.286 179.78 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.516 ' HB2' ' O ' ' B' ' 18' ' ' MET . 22.3 mm-40 -85.77 -11.57 53.19 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.292 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.1 -6.02 84.08 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.791 -178.428 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.698 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.1 mt -74.08 174.69 8.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.57 0.7 . . . . 0.0 111.529 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 23.1 p -116.95 168.88 9.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.665 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 1.5 mttm -47.52 -41.17 20.45 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.322 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.679 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 80.8 p -84.62 -49.74 8.29 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.889 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.49 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.8 mm-40 -64.35 -7.95 11.41 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.628 0.251 . . . . 0.0 110.77 178.805 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 1.061 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.7 tpt -85.88 -48.03 9.12 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 122.741 1.258 . . . . 0.0 107.804 177.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.955 HG21 ' CD1' ' A' ' 5' ' ' ILE . 0.5 OUTLIER -75.89 -38.0 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.041 0 CA-C-N 112.907 -1.951 . . . . 0.0 113.189 -177.744 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.423 HD22 ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -63.69 -46.91 83.38 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.324 1.059 . . . . 0.0 109.092 177.967 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.49 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.3 t -61.62 -43.41 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.209 0 CA-C-N 112.926 -1.943 . . . . 0.0 111.627 -179.104 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.905 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -47.89 -30.5 4.19 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.932 179.797 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.006 HD13 HD21 ' A' ' 15' ' ' LEU . 12.1 mt -90.44 -30.48 17.32 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -177.145 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -71.65 -17.33 62.26 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -110.99 39.06 2.34 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 176.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.568 ' HD2' ' CE1' ' A' ' 36' ' ' HIS . 51.0 t80 -86.08 160.02 19.4 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.792 -178.61 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.521 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.2 mppt? . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.395 -0.812 . . . . 0.0 111.576 178.351 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.505 ' CB ' ' HA ' ' B' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.934 0.397 . . . . 0.0 111.807 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -87.23 165.07 15.96 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.697 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.655 HD22 HD22 ' B' ' 12' ' ' LEU . 2.6 tp -167.94 147.12 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.631 -179.411 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.713 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.5 OUTLIER -125.26 135.77 52.87 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.969 178.97 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.929 HD12 HG21 ' B' ' 30' ' ' ILE . 0.3 OUTLIER -151.22 -174.84 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -178.724 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.78 ' HB3' ' HB3' ' B' ' 27' ' ' SER . 67.5 t-105 -97.03 95.57 7.89 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -177.817 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.825 HD11 ' CG2' ' B' ' 30' ' ' ILE . 1.2 mm? -126.78 103.72 7.68 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 177.55 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.804 ' HA ' ' HD3' ' B' ' 1' ' ' ARG . 0.2 OUTLIER -95.84 -171.38 2.33 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.636 0.732 . . . . 0.0 112.661 -177.442 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -43.3 -56.44 3.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.227 -1.351 . . . . 0.0 112.367 -178.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -50.03 -28.51 7.14 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.159 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.696 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 19.8 p -97.39 -28.49 13.99 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -178.406 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 8' ' ' SER . 21.4 mt -75.49 -40.94 56.62 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 178.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.525 ' O ' ' HB3' ' A' ' 16' ' ' GLU . 2.9 mt-10 -65.79 -40.31 91.82 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 113.766 -1.561 . . . . 0.0 108.076 176.103 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.696 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.4 OUTLIER -47.55 -45.29 26.73 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 114.367 -1.288 . . . . 0.0 110.59 179.039 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.855 HD12 ' HB2' ' A' ' 19' ' ' ALA . 3.5 mm? -77.43 16.73 0.58 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -178.542 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.57 ' CG ' ' HG2' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -74.12 -46.9 39.73 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.632 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.57 ' HG2' ' CG ' ' A' ' 16' ' ' GLU . 1.5 mmtm -96.88 1.95 51.16 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.612 179.029 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.733 ' HB2' HD13 ' A' ' 15' ' ' LEU . 5.0 mtm -108.06 -74.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -178.983 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.855 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -53.46 -50.7 64.74 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.572 0.349 . . . . 0.0 111.827 -178.911 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.07 -61.05 2.89 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.14 0.495 . . . . 0.0 110.481 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.02 -34.18 28.37 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.882 -1.053 . . . . 0.0 110.046 178.65 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -73.53 -20.17 60.72 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.485 179.099 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.05 5.04 74.49 Favored Glycine 0 C--N 1.34 0.788 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.212 -179.14 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.744 HD23 ' C ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -91.55 175.15 7.01 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 121.184 0.516 . . . . 0.0 111.959 -179.134 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.8 p -96.82 164.32 12.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.446 178.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 29' ' ' MET . 10.9 mttm -46.2 -32.14 2.84 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.763 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.626 ' HA ' HD12 ' B' ' 5' ' ' ILE . 6.7 p -77.2 -50.55 12.7 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -178.853 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 32' ' ' VAL . 10.8 mt-10 -55.74 -24.43 35.14 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.851 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.819 ' HG2' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -78.12 -42.33 32.28 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 121.925 0.869 . . . . 0.0 109.029 178.658 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.766 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -78.25 -23.15 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.477 0 CA-C-N 114.195 -1.366 . . . . 0.0 113.359 -176.699 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -72.87 -53.34 11.67 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.749 0.785 . . . . 0.0 109.13 176.288 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.585 HG12 ' O ' ' A' ' 28' ' ' GLU . 12.7 p -61.99 -30.89 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.962 0 CA-C-N 114.128 -1.396 . . . . 0.0 112.594 -177.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.777 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -42.37 -37.69 1.63 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.451 177.879 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.128 HD13 HD23 ' B' ' 15' ' ' LEU . 8.4 mt -87.89 -29.37 20.92 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -177.837 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -69.72 -59.46 2.93 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 -177.523 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.783 ' NE2' ' HB2' ' B' ' 37' ' ' TYR . 9.7 p-80 -56.93 -36.16 69.91 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 119.158 0.89 . . . . 0.0 111.973 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.739 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 10.4 t80 -42.17 145.73 0.35 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 -177.499 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpt . . . . . 0 C--O 1.249 1.039 0 C-N-CA 124.279 1.031 . . . . 0.0 112.769 178.299 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.804 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 120.992 0.425 . . . . 0.0 111.829 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -108.93 116.19 31.52 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 177.55 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.497 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 mm? -130.12 144.66 51.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.388 -178.817 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.713 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -116.02 133.35 56.11 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.502 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.626 HD12 ' HA ' ' A' ' 27' ' ' SER . 0.9 OUTLIER -149.59 -177.71 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.468 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -91.17 87.64 6.61 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -177.094 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.766 HD11 HG22 ' A' ' 30' ' ' ILE . 1.9 mm? -119.81 101.43 7.88 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.814 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.505 ' HA ' ' CB ' ' A' ' 1' ' ' ARG . 48.0 t -67.05 -117.69 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.67 -178.188 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -114.24 -147.35 0.42 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.266 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . 0.473 ' O ' ' HB ' ' B' ' 11' ' ' THR . 1.5 tm0? 34.36 44.4 0.1 Allowed 'General case' 0 C--N 1.346 0.43 0 C-N-CA 123.847 0.859 . . . . 0.0 113.202 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.669 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 1.0 OUTLIER -177.48 -46.5 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.436 178.971 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.655 HD22 HD22 ' A' ' 3' ' ' LEU . 27.1 mt -73.47 -40.65 63.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 175.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -76.95 -37.46 55.23 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 113.297 -1.774 . . . . 0.0 108.161 176.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.669 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -52.32 -20.07 2.5 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.029 178.322 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.128 HD23 HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -71.63 43.96 0.09 Allowed 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 125.172 1.389 . . . . 0.0 112.21 179.323 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -86.73 -58.72 2.5 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.938 179.537 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 51.6 mttp -98.02 22.57 9.19 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -179.261 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.786 ' HB2' HD13 ' B' ' 15' ' ' LEU . 0.5 OUTLIER -103.15 -84.68 0.46 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.663 179.75 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.579 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -49.0 -41.75 35.51 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.018 0.527 . . . . 0.0 111.185 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 6.1 mtt-85 -64.35 -67.77 0.41 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.965 0.412 . . . . 0.0 111.078 -179.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -32.65 44.44 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.969 179.049 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' B' ' 18' ' ' MET . 37.8 mt-10 -82.66 -17.15 45.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.945 179.747 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.09 9.41 86.97 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -177.301 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 95.3 mt -88.62 171.48 10.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.555 0.742 . . . . 0.0 111.769 -179.445 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 87.5 p -110.53 163.34 13.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.074 177.578 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -43.25 -38.55 2.62 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -179.214 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.78 ' HB3' ' HB3' ' A' ' 6' ' ' TRP . 69.5 m -83.2 -52.14 6.85 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.631 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.44 -11.58 44.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.132 0.491 . . . . 0.0 110.562 178.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.986 ' SD ' HD11 ' B' ' 15' ' ' LEU . 2.9 tpt -81.59 -45.25 16.12 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 177.306 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.929 HG21 HD12 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -74.52 -25.79 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.689 0 CA-C-N 112.58 -2.1 . . . . 0.0 112.872 -178.13 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.538 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -63.45 -50.37 69.99 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.842 0.829 . . . . 0.0 109.282 177.508 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.538 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 14.0 p -74.44 -31.26 27.6 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.552 0 CA-C-N 113.788 -1.551 . . . . 0.0 113.572 -176.868 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.83 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -53.96 -38.41 64.95 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-O 122.121 0.962 . . . . 0.0 109.235 177.469 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.027 HD13 ' N ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -77.77 -41.29 38.01 Favored 'General case' 0 N--CA 1.399 -3.009 0 CA-C-N 113.878 -1.51 . . . . 0.0 110.738 -178.768 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . 1.027 ' N ' HD13 ' B' ' 34' ' ' LEU . 5.5 mt-30 -57.12 -62.19 1.93 Allowed 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.186 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.83 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 2.9 p-80 -53.33 -32.51 49.37 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 119.854 1.206 . . . . 0.0 110.778 179.695 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.783 ' HB2' ' NE2' ' A' ' 36' ' ' HIS . 62.8 t80 -61.94 160.01 13.08 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -178.306 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.59 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 10.5 mmmt . . . . . 0 C--O 1.248 0.987 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.85 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.644 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.018 0.437 . . . . 0.0 111.828 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.406 ' C ' HD22 ' A' ' 3' ' ' LEU . 82.3 m95 -114.94 114.6 25.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.132 177.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.486 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -131.98 154.98 48.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.421 -178.866 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.937 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 1.1 m -124.38 131.55 53.51 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.788 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.878 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -146.02 176.93 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.364 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.46 ' C ' HD22 ' A' ' 7' ' ' LEU . 74.0 t-105 -97.88 97.76 9.23 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -177.155 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.775 HD21 ' CD1' ' A' ' 5' ' ' ILE . 1.5 mm? -121.68 112.16 18.07 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 177.08 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.445 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 17.4 p -80.16 -145.94 0.05 OUTLIER 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 120.786 0.327 . . . . 0.0 111.411 -178.647 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.69 ' O ' HG22 ' A' ' 11' ' ' THR . 2.5 p-10 -75.87 -159.82 0.12 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.953 -179.087 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.46 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 tt0 36.11 44.87 0.29 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.487 0.715 . . . . 0.0 112.62 179.048 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.755 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 12.4 t -176.01 -43.98 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.087 179.167 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.573 HD21 ' HB2' ' A' ' 7' ' ' LEU . 27.8 mt -71.03 -42.28 69.74 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 175.943 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -68.15 -39.5 82.63 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 113.286 -1.779 . . . . 0.0 107.521 176.017 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.755 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.1 t70 -50.21 -36.33 30.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.274 178.803 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.986 ' CD2' HD13 ' B' ' 34' ' ' LEU . 51.3 mt -66.82 6.08 0.54 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -69.16 -61.93 1.59 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.228 -0.295 . . . . 0.0 110.687 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.564 ' HA ' ' HB2' ' A' ' 21' ' ' ARG . 1.1 mttm -77.92 -11.3 59.88 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.908 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 9.6 mtm -93.95 -29.57 15.19 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.261 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.771 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -103.98 -64.49 1.1 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.917 -0.129 . . . . 0.0 111.214 179.642 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 -57.94 -63.71 1.16 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.149 0.5 . . . . 0.0 111.791 -179.61 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.564 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 0.8 OUTLIER -51.78 -31.02 25.33 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.483 179.609 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.506 ' HB2' ' O ' ' A' ' 18' ' ' MET . 20.0 mm-40 -92.66 -6.12 49.99 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.389 179.989 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.59 -3.51 78.25 Favored Glycine 0 C--N 1.338 0.694 0 C-N-CA 120.618 -0.801 . . . . 0.0 111.992 -178.58 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.771 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 84.7 mt -75.27 171.49 14.1 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.561 0.696 . . . . 0.0 111.482 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 96.0 p -118.32 163.11 17.19 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.59 -1.187 . . . . 0.0 109.674 178.622 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.419 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -39.43 -37.84 0.5 Allowed 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -179.532 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.631 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 3.4 m -83.98 -56.88 3.44 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.425 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' HD22 ' A' ' 24' ' ' LEU . 3.1 mt-10 -61.87 -9.66 7.37 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.675 0.274 . . . . 0.0 110.437 179.017 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.908 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.6 tpt -85.64 -48.34 8.97 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 122.742 1.258 . . . . 0.0 108.057 178.083 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.086 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.03 -39.87 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 112.887 -1.96 . . . . 0.0 112.873 -177.796 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.422 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -60.71 -46.25 91.11 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 122.215 1.007 . . . . 0.0 108.647 177.462 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.422 ' N ' HD22 ' A' ' 31' ' ' ASN . 1.1 t -59.36 -43.11 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 CA-C-N 113.155 -1.838 . . . . 0.0 110.509 179.844 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.775 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -55.34 -33.33 63.27 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.543 178.466 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.848 HD13 HD21 ' B' ' 15' ' ' LEU . 14.2 mt -77.68 -30.15 51.81 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.044 -178.747 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -80.1 -17.04 53.65 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.244 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -110.59 15.15 22.22 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 178.735 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -69.48 -166.29 0.1 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 122.942 0.497 . . . . 0.0 109.956 178.823 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HD3' ' N ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.489 1.516 . . . . 0.0 112.606 -178.091 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.375 0.131 . . . . 0.0 111.291 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . 0.5 ' C ' HD22 ' B' ' 3' ' ' LEU . 91.8 m95 -84.79 121.25 27.43 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.786 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.5 HD22 ' C ' ' B' ' 2' ' ' TRP . 2.3 mm? -137.36 153.19 50.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.146 -179.549 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.937 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -115.88 130.57 56.89 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.572 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.086 ' CD1' HG21 ' A' ' 30' ' ' ILE . 4.4 pt -142.4 172.63 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.673 ' O ' HD13 ' B' ' 7' ' ' LEU . 73.2 t-105 -99.6 104.61 16.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -177.446 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.855 HD11 HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -132.39 114.66 14.61 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 177.554 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.644 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 10.4 p -77.26 -173.55 2.88 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.636 0.732 . . . . 0.0 112.702 -177.954 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -48.29 -62.93 1.23 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.644 -1.162 . . . . 0.0 112.336 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.69 -28.71 9.55 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -178.551 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.63 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 74.1 p -86.33 -32.2 21.14 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -178.713 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' B' ' 8' ' ' SER . 52.2 mt -71.33 -39.91 71.08 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 177.916 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -62.44 -41.67 98.9 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 113.469 -1.696 . . . . 0.0 107.793 175.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' B' ' 18' ' ' MET . 0.7 OUTLIER -54.48 -47.54 72.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.205 178.876 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.848 HD21 HD13 ' A' ' 34' ' ' LEU . 15.2 mt -74.75 27.65 0.09 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -179.479 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -109.15 -55.3 2.43 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.87 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.83 -36.95 41.77 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.498 178.581 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.714 ' HA ' ' HG3' ' B' ' 22' ' ' GLU . 13.6 mtm -73.23 -16.82 61.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.455 178.58 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.812 ' HA ' ' CD2' ' B' ' 24' ' ' LEU . . . -97.93 -69.17 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.44 -179.485 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.86 -69.41 0.21 Allowed 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.966 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.46 -32.08 7.26 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.834 -179.766 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.714 ' HG3' ' HA ' ' B' ' 18' ' ' MET . 2.9 mt-10 -83.86 -24.36 30.9 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -179.386 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.439 ' O ' ' HB3' ' B' ' 24' ' ' LEU . . . 99.18 64.04 0.84 Allowed Glycine 0 C--N 1.334 0.47 0 C-N-CA 120.224 -0.988 . . . . 0.0 113.916 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.812 ' CD2' ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -179.11 -177.62 0.48 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.883 0.373 . . . . 0.0 111.088 177.77 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . 0.588 ' N ' HD23 ' B' ' 24' ' ' LEU . 3.5 t -114.94 174.78 5.8 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.667 -179.149 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.425 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 0.0 OUTLIER -43.84 -38.92 3.56 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.083 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.545 ' HA ' HD12 ' A' ' 5' ' ' ILE . 3.2 p -80.3 -56.0 4.51 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 117.523 0.147 . . . . 0.0 111.351 -179.552 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.683 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 3.4 mm-40 -62.93 -11.8 21.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.555 0.217 . . . . 0.0 110.534 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.805 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.1 tpt -81.97 -47.6 12.5 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 122.699 1.238 . . . . 0.0 107.736 177.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.878 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -74.31 -37.92 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.11 0 CA-C-N 112.894 -1.957 . . . . 0.0 112.944 -177.846 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -61.57 -48.38 81.23 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 122.26 1.029 . . . . 0.0 108.543 176.9 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.503 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -58.04 -41.94 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 CA-C-N 113.015 -1.902 . . . . 0.0 111.561 -179.436 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.764 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -53.16 -37.61 62.03 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.902 179.194 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.986 HD13 ' CD2' ' A' ' 15' ' ' LEU . 15.4 mt -75.56 -31.97 60.23 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.774 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -77.82 -17.79 57.05 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.516 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 61.9 m80 -96.23 -35.28 11.33 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 121.259 -0.176 . . . . 0.0 110.99 177.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.545 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 13.4 t80 -40.89 143.09 0.4 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.651 0.38 . . . . 0.0 111.091 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt . . . . . 0 C--O 1.251 1.139 0 C-N-CA 123.587 0.755 . . . . 0.0 112.299 179.035 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.706 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 2.5 mpt_? . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.917 0.389 . . . . 0.0 111.518 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.415 ' C ' HD22 ' A' ' 3' ' ' LEU . 87.9 m95 -104.68 116.35 31.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.001 178.745 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.513 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.8 mm? -133.21 157.4 45.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.72 -179.57 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.7 OUTLIER -113.88 138.41 50.34 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.783 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.572 ' CD1' ' HB2' ' A' ' 7' ' ' LEU . 2.3 pp -154.69 167.5 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.37 0.605 . . . . 0.0 112.351 -178.589 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.521 ' O ' ' HB3' ' B' ' 27' ' ' SER . 68.0 t-105 -79.02 88.69 4.78 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.374 179.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.615 HD23 HD22 ' B' ' 3' ' ' LEU . 29.9 tp -125.83 84.62 2.29 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.938 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.608 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 47.9 p -63.41 175.39 1.02 Allowed 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 122.248 1.023 . . . . 0.0 113.631 -177.067 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -55.99 -44.46 78.61 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 113.186 -1.825 . . . . 0.0 112.709 -179.35 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -40.54 -37.59 0.73 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.748 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.762 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 1.4 t -109.29 -11.03 14.92 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -178.859 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 8' ' ' SER . 66.5 mt -70.05 -38.44 75.82 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 175.881 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.89 -40.79 98.61 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 113.164 -1.835 . . . . 0.0 107.952 176.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.762 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 0.2 OUTLIER -53.14 -42.99 66.6 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.717 -1.129 . . . . 0.0 109.461 178.497 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.033 HD21 HD13 ' B' ' 34' ' ' LEU . 28.9 mt -75.86 19.71 0.2 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 57.3 mt-10 -99.27 -50.24 4.19 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.28 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -81.37 -33.63 32.24 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.712 178.528 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.553 ' O ' ' HB3' ' A' ' 22' ' ' GLU . 25.0 mtm -67.65 -69.92 0.29 Allowed 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.092 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.748 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -37.27 -44.91 0.62 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.558 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -70.23 0.27 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.064 0.459 . . . . 0.0 111.309 -179.764 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -52.01 -27.43 13.52 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.573 179.443 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.609 ' OE1' HG11 ' A' ' 32' ' ' VAL . 0.0 OUTLIER -86.11 -35.23 20.34 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.81 -179.874 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.55 ' O ' ' HB3' ' A' ' 24' ' ' LEU . . . 102.12 73.3 0.99 Allowed Glycine 0 C--N 1.342 0.863 0 C-N-CA 120.5 -0.857 . . . . 0.0 113.753 178.87 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.748 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER 169.46 -174.35 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 121.354 0.597 . . . . 0.0 112.346 177.962 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.06 169.42 8.45 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -43.67 -40.2 4.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -179.069 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.808 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 23.9 m -78.08 -56.47 4.45 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 -179.267 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.598 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mt-10 -60.54 -18.71 54.02 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.055 0.455 . . . . 0.0 109.838 178.762 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.935 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.2 tpt -71.53 -47.86 52.5 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 123.122 1.439 . . . . 0.0 107.916 177.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.059 HG21 HD12 ' B' ' 5' ' ' ILE . 0.4 OUTLIER -69.61 -28.36 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.614 0 CA-C-N 112.461 -2.154 . . . . 0.0 113.155 -178.484 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.427 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -67.08 -49.39 65.19 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.937 0.875 . . . . 0.0 108.946 177.052 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.609 HG11 ' OE1' ' A' ' 22' ' ' GLU . 0.9 OUTLIER -57.4 -42.42 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.95 -179.905 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.873 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.87 -39.84 54.95 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.038 178.976 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.099 HD13 HD21 ' B' ' 15' ' ' LEU . 13.5 mt -73.45 -28.98 62.25 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.474 -178.32 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.438 ' NE2' ' HA ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -78.93 -19.76 50.99 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.08 -179.503 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -104.61 -35.89 7.67 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 178.281 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.576 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.3 t80 -30.79 130.87 0.1 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.0 0.52 . . . . 0.0 112.135 -179.753 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.437 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-O 117.993 -1.003 . . . . 0.0 112.07 177.956 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.608 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.802 0.334 . . . . 0.0 111.523 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -74.78 145.64 42.77 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.322 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.615 HD22 HD23 ' A' ' 7' ' ' LEU . 1.7 tp -158.05 150.63 22.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.165 -178.85 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 1.3 m -111.02 140.68 45.35 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.059 HD12 HG21 ' A' ' 30' ' ' ILE . 3.7 pt -148.41 179.8 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.98 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.808 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 72.3 t-105 -99.96 101.41 12.5 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 -177.187 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.829 HD11 ' CG2' ' A' ' 30' ' ' ILE . 0.4 OUTLIER -133.47 113.1 12.12 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 177.172 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.706 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.1 OUTLIER -89.84 -165.83 1.44 Allowed 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.415 0.626 . . . . 0.0 112.302 -178.132 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -47.79 -65.4 0.57 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.774 -178.476 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -49.3 -25.38 2.35 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -178.532 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.699 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 30.2 p -94.65 -38.89 10.62 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.552 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' B' ' 8' ' ' SER . 74.6 mt -63.93 -40.83 97.36 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 178.412 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -63.33 -43.18 98.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 113.747 -1.57 . . . . 0.0 107.975 176.298 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.699 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.2 OUTLIER -53.71 -45.28 70.39 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.332 178.751 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.099 HD21 HD13 ' A' ' 34' ' ' LEU . 18.0 mt -72.72 28.36 0.06 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -179.343 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.524 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 6.2 mm-40 -109.55 -56.28 2.32 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.16 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.489 ' O ' ' HB2' ' B' ' 21' ' ' ARG . 1.1 mttm -75.86 -25.53 56.27 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.05 178.698 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.855 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 16.0 mtm -87.04 -23.35 25.0 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.208 179.787 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.717 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -101.34 -67.63 0.85 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.789 -179.961 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -54.07 -67.04 0.29 Allowed 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.146 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' B' ' 17' ' ' LYS . 4.8 mmm180 -49.01 -32.31 9.05 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.383 179.717 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.4 mm-40 -88.94 -6.64 57.13 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.466 179.808 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.42 -8.07 69.78 Favored Glycine 0 C--N 1.338 0.687 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.814 -178.526 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.717 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 82.6 mt -74.12 170.91 14.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.668 0.747 . . . . 0.0 111.605 -179.901 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 4.6 m -118.62 162.7 17.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.427 -1.26 . . . . 0.0 109.37 178.281 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.458 ' HB3' HG21 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -40.55 -37.46 0.71 Allowed 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -179.077 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.521 ' HB3' ' O ' ' A' ' 6' ' ' TRP . 0.7 OUTLIER -82.55 -57.56 3.29 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 122.697 0.399 . . . . 0.0 111.689 -179.538 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.53 ' HB3' HD22 ' B' ' 24' ' ' LEU . 3.2 mt-10 -61.69 -10.87 9.59 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.34 178.899 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 1.031 ' CG ' HD22 ' B' ' 15' ' ' LEU . 2.5 tpt -83.71 -47.86 10.74 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 122.769 1.271 . . . . 0.0 107.836 177.955 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.767 HD13 HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -73.64 -33.25 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.09 0 CA-C-N 112.791 -2.004 . . . . 0.0 113.147 -177.906 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.449 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -70.13 -48.7 56.4 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.94 0.876 . . . . 0.0 109.338 177.394 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 1.2 t -56.22 -40.3 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-N 113.499 -1.682 . . . . 0.0 110.642 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.722 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -53.63 -32.68 52.33 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.799 -1.092 . . . . 0.0 111.482 179.005 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.033 HD13 HD21 ' A' ' 15' ' ' LEU . 11.3 mt -82.36 -32.83 29.09 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.78 -177.825 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -80.54 -8.42 59.57 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -112.17 8.21 19.81 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.488 0.185 . . . . 0.0 111.327 177.665 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.544 ' CD2' ' HD2' ' B' ' 38' ' ' LYS . 3.3 t80 -66.3 -169.29 0.07 Allowed 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.085 0.554 . . . . 0.0 109.6 178.592 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.544 ' HD2' ' CD2' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.363 1.465 . . . . 0.0 112.915 -178.408 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' B' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 120.815 0.34 . . . . 0.0 111.864 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -98.37 114.6 26.99 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.444 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.548 HD21 HG12 ' A' ' 5' ' ' ILE . 3.2 tp -122.25 142.39 50.51 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.266 -177.931 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.6 OUTLIER -123.76 128.77 50.05 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.663 178.217 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 1.028 HD12 HD21 ' A' ' 7' ' ' LEU . 1.1 pp -155.75 173.71 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -178.076 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.674 ' O ' HD13 ' A' ' 7' ' ' LEU . 74.9 t-105 -95.28 112.64 24.32 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -176.83 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.028 HD21 HD12 ' A' ' 5' ' ' ILE . 0.4 OUTLIER -129.52 122.65 29.65 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.519 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.893 ' C ' HD23 ' A' ' 12' ' ' LEU . 9.8 p -80.31 -173.23 3.92 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-O 121.318 0.58 . . . . 0.0 110.412 -179.802 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -61.93 -162.11 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.201 -178.645 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.495 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.9 mm-40 36.54 40.43 0.12 Allowed 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.635 0.774 . . . . 0.0 112.805 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.718 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 2.0 t -179.78 -56.46 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.002 179.441 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.931 HD22 ' HB2' ' B' ' 1' ' ' ARG . 0.6 OUTLIER -62.61 -29.1 70.36 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 175.831 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.458 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 2.8 mm-40 -92.43 -37.5 12.52 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 113.609 -1.632 . . . . 0.0 108.692 177.201 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.718 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.0 OUTLIER -45.34 -31.03 1.45 Allowed 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.718 179.472 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.99 HD22 ' CG ' ' A' ' 29' ' ' MET . 43.8 mt -72.47 19.21 0.08 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 179.609 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -95.88 -48.6 5.66 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.217 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -84.63 -38.09 20.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.556 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.461 ' O ' ' N ' ' A' ' 20' ' ' ARG . 17.2 mtm -64.26 -72.69 0.14 Allowed 'General case' 0 C--N 1.341 0.239 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.427 179.466 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.812 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -28.5 -32.17 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.888 1.368 . . . . 0.0 113.934 -178.602 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.505 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 3.7 mmm180 -66.22 -121.2 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 119.729 -0.789 . . . . 0.0 110.35 179.194 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.38 -23.13 8.81 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 121.876 -0.515 . . . . 0.0 111.671 179.51 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.457 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 1.3 mp0 -109.07 -2.85 17.84 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 -177.198 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.812 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -150.19 21.31 1.09 Allowed Glycine 0 C--O 1.221 -0.713 0 C-N-CA 115.766 -3.111 . . . . 0.0 117.693 -176.756 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.673 HD12 ' C ' ' A' ' 23' ' ' GLY . 1.2 mp 51.31 -159.88 0.09 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 119.74 1.77 . . . . 0.0 113.353 175.63 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -60.82 165.21 4.15 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 114.282 -1.326 . . . . 0.0 110.373 178.535 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -43.87 66.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.311 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 m -80.71 -46.92 14.75 Favored 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.283 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.576 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 2.5 mm-40 -57.36 -27.49 62.33 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.591 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.99 ' CG ' HD22 ' A' ' 15' ' ' LEU . 4.2 tpt -63.61 -48.3 77.88 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 122.925 1.345 . . . . 0.0 109.109 177.702 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.966 HG21 ' CD1' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -77.94 -29.78 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.407 -2.582 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.128 -176.282 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -71.75 -50.02 33.83 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.052 0.929 . . . . 0.0 109.459 177.785 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 1.3 t -57.85 -42.86 83.17 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.817 -179.488 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.936 ' HB1' ' O ' ' B' ' 33' ' ' ALA . . . -50.51 -27.71 7.12 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.625 179.154 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.928 HD13 HD21 ' B' ' 15' ' ' LEU . 10.9 mt -91.42 -30.91 16.24 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.922 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -75.7 -14.24 60.34 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.076 0.398 . . . . 0.0 112.076 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -111.04 35.6 3.48 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.491 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.586 ' CD2' ' N ' ' A' ' 38' ' ' LYS . 67.3 t80 -74.31 162.22 29.11 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.116 -0.947 . . . . 0.0 113.341 -178.735 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.586 ' N ' ' CD2' ' A' ' 37' ' ' TYR . 6.8 mmmt . . . . . 0 C--O 1.251 1.136 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.086 177.794 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.931 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 120.785 0.326 . . . . 0.0 111.878 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . 0.437 ' C ' HD22 ' B' ' 3' ' ' LEU . 97.6 m95 -89.56 122.46 32.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.834 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.6 mm? -133.61 151.07 51.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.958 0.409 . . . . 0.0 111.95 -178.605 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.934 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER -123.78 124.25 42.28 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.257 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.966 ' CD1' HG21 ' A' ' 30' ' ' ILE . 3.8 pt -147.21 176.99 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.794 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.677 ' O ' HD13 ' B' ' 7' ' ' LEU . 70.6 t-105 -96.9 101.82 13.48 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -177.268 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.904 HD11 HG22 ' A' ' 30' ' ' ILE . 0.7 OUTLIER -130.85 112.26 12.85 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.476 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.582 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 9.8 p -84.76 178.92 7.46 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 122.029 0.919 . . . . 0.0 113.028 -177.89 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -47.69 -49.15 28.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 113.321 -1.763 . . . . 0.0 112.781 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -43.46 -35.02 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.527 -178.846 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.771 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 3.9 t -112.28 -7.74 13.99 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -179.202 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' B' ' 8' ' ' SER . 73.8 mt -72.88 -38.96 66.8 Favored 'General case' 0 CA--C 1.511 -0.551 0 N-CA-C 105.937 -1.875 . . . . 0.0 105.937 175.762 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.54 -41.35 98.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.285 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.771 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.1 OUTLIER -52.2 -43.05 64.01 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.622 178.794 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.928 HD21 HD13 ' A' ' 34' ' ' LEU . 16.5 mt -79.09 22.88 0.38 Allowed 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 -179.628 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -43.35 4.48 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.958 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -80.71 -46.91 14.77 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 122.301 0.24 . . . . 0.0 111.524 179.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.781 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 0.4 OUTLIER -81.32 10.04 6.2 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.799 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.413 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -111.04 -61.06 1.75 Allowed 'General case' 0 C--O 1.225 -0.234 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.542 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.492 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 29.9 mmm-85 -62.0 -63.51 1.23 Allowed 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 121.182 0.515 . . . . 0.0 111.505 179.191 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -34.56 35.35 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.844 179.534 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -80.48 -12.65 59.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.673 179.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.59 -12.91 68.69 Favored Glycine 0 C--N 1.341 0.855 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.76 -178.666 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.426 HD22 ' HB3' ' B' ' 28' ' ' GLU . 43.4 mt -74.26 175.3 7.72 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.907 0.86 . . . . 0.0 112.22 -179.793 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -118.33 173.29 6.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.166 178.139 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.56 -38.85 60.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 7.3 m -79.79 -52.66 7.64 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.539 0.209 . . . . 0.0 111.029 179.819 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.426 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.7 mm-40 -63.82 -13.52 45.25 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.262 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.786 ' HG2' ' HB3' ' B' ' 15' ' ' LEU . 1.2 tpt -80.84 -45.77 16.37 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 123.714 1.721 . . . . 0.0 107.176 177.129 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 1.022 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -65.71 -17.91 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.772 0 CA-C-N 112.943 -1.935 . . . . 0.0 111.957 -179.099 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.411 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -80.34 -47.51 14.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.075 176.82 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.754 HG23 ' HE3' ' B' ' 29' ' ' MET . 0.1 OUTLIER -59.25 -30.94 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 CA-C-O 121.665 0.745 . . . . 0.0 108.996 178.549 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 1.034 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -37.42 -44.35 0.63 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 113.722 -1.581 . . . . 0.0 110.924 177.919 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.9 HD22 HD21 ' A' ' 15' ' ' LEU . 9.2 mt -83.78 -30.45 26.59 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.534 -179.392 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' B' ' 32' ' ' VAL . 13.2 mt-30 -82.89 -15.61 50.8 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.426 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 1.034 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 1.0 OUTLIER -118.3 6.06 11.89 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -179.974 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.679 ' HB2' ' HA ' ' A' ' 33' ' ' ALA . 1.0 OUTLIER -78.49 137.84 38.14 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.172 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.451 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 117.931 -1.033 . . . . 0.0 112.025 178.366 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.881 ' HB2' HD22 ' B' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 111.731 0.271 . . . . 0.0 111.731 . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -88.96 118.39 28.65 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.107 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.456 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.7 mm? -131.85 154.76 48.84 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.73 -178.719 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -127.03 135.23 50.53 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.164 178.775 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 1.028 HD13 HD13 ' A' ' 7' ' ' LEU . 2.3 pp -151.12 171.86 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.898 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.62 ' HB3' ' CB ' ' B' ' 27' ' ' SER . 73.2 t-105 -84.76 91.64 8.02 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -178.036 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.028 HD13 HD13 ' A' ' 5' ' ' ILE . 2.9 mp -131.45 98.68 4.59 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 177.038 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.83 ' HA ' ' HB3' ' B' ' 1' ' ' ARG . 0.1 OUTLIER -74.07 -168.22 0.6 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.525 0.678 . . . . 0.0 112.127 -177.863 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -55.17 -54.39 43.88 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.478 -1.237 . . . . 0.0 113.078 -178.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -50.35 -22.58 1.89 Allowed 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.559 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.47 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 15.7 p -96.72 -25.46 15.52 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -178.718 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 8' ' ' SER . 20.0 mt -78.8 -37.33 41.11 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 106.706 -1.59 . . . . 0.0 106.706 178.613 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -56.96 -41.29 78.04 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 174.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.577 ' O ' ' HG3' ' A' ' 18' ' ' MET . 0.1 OUTLIER -55.63 -47.44 76.59 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.683 177.421 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.867 HD21 HD22 ' B' ' 34' ' ' LEU . 22.3 mt -81.32 31.56 0.34 Allowed 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.11 -0.95 . . . . 0.0 112.829 179.657 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.425 ' HG2' ' N ' ' A' ' 17' ' ' LYS . 0.2 OUTLIER -113.78 -49.58 2.87 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 178.687 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.425 ' N ' ' HG2' ' A' ' 16' ' ' GLU . 2.1 ptmm? -88.83 -28.8 20.16 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.613 0.365 . . . . 0.0 111.056 178.577 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.66 ' HE2' HD23 ' A' ' 15' ' ' LEU . 6.9 mtm -87.04 -8.17 57.38 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.567 178.743 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.888 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -89.69 -18.99 25.37 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -178.063 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' A' ' 16' ' ' GLU . 0.1 OUTLIER -64.28 -134.77 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.863 -179.485 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.36 -22.5 1.14 Allowed 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.552 -0.717 . . . . 0.0 110.199 178.274 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.524 ' HB3' ' OH ' ' B' ' 37' ' ' TYR . 1.8 mp0 -90.9 -22.14 21.06 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -178.526 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.888 ' HA3' ' HA ' ' A' ' 19' ' ' ALA . . . -139.2 17.97 3.13 Favored Glycine 0 CA--C 1.504 -0.646 0 C-N-CA 117.313 -2.375 . . . . 0.0 116.702 -176.736 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.74 HD12 ' C ' ' A' ' 23' ' ' GLY . 0.9 OUTLIER 53.75 -163.26 0.11 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 118.679 1.24 . . . . 0.0 114.212 174.953 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.2 m -58.66 163.33 3.32 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 113.727 -1.579 . . . . 0.0 110.593 178.692 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -51.13 -43.81 61.24 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.801 0.296 . . . . 0.0 111.801 -179.474 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.0 m -77.08 -39.59 49.19 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.543 0.211 . . . . 0.0 111.023 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.623 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.8 mt-10 -64.81 -36.45 84.37 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.282 179.508 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.862 ' HE3' HG23 ' A' ' 32' ' ' VAL . 2.4 tpt -61.3 -44.66 96.84 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 123.96 1.838 . . . . 0.0 108.407 177.445 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.983 HG21 HD13 ' B' ' 5' ' ' ILE . 0.3 OUTLIER -68.28 -18.6 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 112.97 -1.923 . . . . 0.0 112.265 -177.543 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.14 -45.23 16.72 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 176.168 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.862 HG23 ' HE3' ' A' ' 29' ' ' MET . 0.0 OUTLIER -60.39 -32.33 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.467 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 1.053 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -39.98 -42.0 1.3 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.163 -1.38 . . . . 0.0 110.536 177.83 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.927 HD22 HD21 ' B' ' 15' ' ' LEU . 9.8 mt -83.12 -29.7 28.49 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.726 -179.674 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.444 ' N ' ' O ' ' A' ' 32' ' ' VAL . 8.5 mt-30 -87.67 -18.62 29.15 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -179.489 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 1.053 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -109.44 4.52 22.49 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.418 0.554 . . . . 0.0 112.412 179.687 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.585 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 1.9 t80 -79.85 145.61 32.65 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 178.661 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.477 ' HD3' ' CZ ' ' A' ' 37' ' ' TYR . 2.6 ttpt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.729 -0.653 . . . . 0.0 112.245 179.48 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.83 ' HB3' ' HA ' ' A' ' 8' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.908 0.385 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . 0.484 ' O ' ' HD3' ' B' ' 1' ' ' ARG . 99.2 m95 -69.26 174.84 4.33 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.697 179.896 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.536 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.9 tp -169.14 137.38 1.95 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.703 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -117.16 138.69 51.5 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.683 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.043 HD12 HD21 ' B' ' 7' ' ' LEU . 1.3 pp -161.81 173.63 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.222 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.518 ' O ' HD13 ' B' ' 7' ' ' LEU . 74.7 t-105 -93.0 114.25 26.75 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.463 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 1.043 HD21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -128.97 123.78 33.34 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.561 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.868 ' O ' HD23 ' B' ' 12' ' ' LEU . 11.6 p -81.5 -174.24 4.85 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.839 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -63.3 -163.55 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.808 -178.827 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . 0.408 ' O ' ' HB ' ' B' ' 11' ' ' THR . 0.0 OUTLIER 35.37 41.75 0.09 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.447 0.699 . . . . 0.0 112.723 179.014 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.642 ' HA ' ' CB ' ' B' ' 14' ' ' ASP . 0.7 OUTLIER -178.38 -56.15 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.998 179.678 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.881 HD22 ' HB2' ' A' ' 1' ' ' ARG . 1.0 OUTLIER -61.97 -30.38 70.89 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.445 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -95.46 -35.87 11.54 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.547 -1.66 . . . . 0.0 109.06 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.642 ' CB ' ' HA ' ' B' ' 11' ' ' THR . 6.6 t70 -44.69 -31.17 1.09 Allowed 'General case' 0 C--N 1.343 0.306 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.217 179.779 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.927 HD21 HD22 ' A' ' 34' ' ' LEU . 44.2 mt -67.64 14.69 0.05 Allowed 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.496 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -83.23 -42.11 17.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.262 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.487 ' HG3' ' HG2' ' B' ' 16' ' ' GLU . 5.1 mtpm? -91.37 -21.62 20.9 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.368 179.009 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.872 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 2.6 mtm -83.98 -26.51 29.14 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.586 -179.731 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.744 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -99.22 -69.51 0.76 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.637 179.565 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER -53.16 -67.82 0.22 Allowed 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.35 -33.71 14.13 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.365 -179.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.562 ' HB2' ' O ' ' B' ' 18' ' ' MET . 19.3 mm-40 -85.5 -11.2 54.77 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.16 179.703 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.94 -9.1 78.42 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.624 -178.219 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.744 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 60.3 mt -75.76 177.77 6.63 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 121.543 0.687 . . . . 0.0 111.52 179.963 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 12.1 p -124.51 170.41 10.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.98 -40.59 6.56 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.62 ' CB ' ' HB3' ' A' ' 6' ' ' TRP . 3.8 p -85.83 -51.37 6.45 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -179.802 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.579 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 3.9 mm-40 -64.04 -4.18 3.24 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 121.388 -0.125 . . . . 0.0 111.292 179.579 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.872 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 3.5 tpt -94.33 -50.3 5.31 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 177.666 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.874 HG22 HD11 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -73.59 -36.66 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.911 0 CA-C-N 113.311 -1.768 . . . . 0.0 112.677 -178.426 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.428 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.62 -48.94 65.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.941 0.877 . . . . 0.0 109.441 177.344 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.579 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 0.9 OUTLIER -59.92 -36.79 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 111.376 -179.851 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.944 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -50.74 -32.47 19.75 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.105 179.209 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.867 HD22 HD21 ' A' ' 15' ' ' LEU . 13.4 mt -90.64 -28.92 18.07 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.557 -177.634 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -68.92 -19.66 64.2 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.49 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -102.84 25.71 8.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.863 0.363 . . . . 0.0 110.382 177.101 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.68 ' CD1' ' N ' ' B' ' 38' ' ' LYS . 1.4 t80 -103.8 144.49 31.42 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.667 -179.524 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.68 ' N ' ' CD1' ' B' ' 37' ' ' TYR . 2.1 mppt? . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.455 -0.783 . . . . 0.0 111.191 178.159 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.75 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 1.8 mpt_? . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 120.921 0.391 . . . . 0.0 111.661 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -100.19 121.19 41.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.48 178.4 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.507 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -132.44 137.07 47.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.49 -178.63 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.935 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -119.34 128.39 54.07 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.553 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.92 HD11 HG21 ' B' ' 30' ' ' ILE . 4.1 pt -151.29 -178.86 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.231 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.423 ' O ' HD13 ' A' ' 7' ' ' LEU . 76.2 t-105 -93.52 96.39 9.84 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -177.097 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.817 HD11 HG22 ' B' ' 30' ' ' ILE . 1.4 mm? -121.54 117.73 27.5 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 176.39 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.696 ' C ' HD23 ' A' ' 12' ' ' LEU . 50.7 p -65.84 165.93 12.04 Favored 'General case' 0 N--CA 1.427 -1.589 0 CA-C-O 122.21 1.005 . . . . 0.0 111.283 -178.336 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.466 ' CG ' ' HG3' ' A' ' 13' ' ' GLU . 5.8 t70 -60.65 -35.74 76.96 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 113.237 -1.801 . . . . 0.0 113.077 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -71.37 32.25 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.629 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.755 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -171.18 -50.26 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 122.881 0.472 . . . . 0.0 111.787 178.618 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.789 ' CD2' ' HD2' ' B' ' 1' ' ' ARG . 0.4 OUTLIER -56.3 -29.83 61.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 176.836 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.466 ' HG3' ' CG ' ' A' ' 9' ' ' ASP . 3.0 mm-40 -88.28 -38.24 15.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.321 -1.309 . . . . 0.0 108.571 177.393 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.755 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 4.7 t70 -44.72 -24.45 0.2 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.214 178.158 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.94 HD21 HD13 ' B' ' 34' ' ' LEU . 50.1 mt -67.51 14.6 0.05 Allowed 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 179.325 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 17.8 mt-10 -87.01 -44.62 11.45 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.42 ' HG2' ' NH2' ' A' ' 21' ' ' ARG . 18.2 mttp -79.5 -22.77 43.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.067 178.966 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.986 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 5.0 mtm -90.25 -23.61 21.18 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.047 -179.167 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.748 ' HA ' ' HB2' ' A' ' 24' ' ' LEU . . . -102.3 -65.87 0.96 Allowed 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 6.4 mtp85 -55.41 -67.7 0.26 Allowed 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.013 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' NH2' ' HG2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -50.27 -30.84 12.71 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.227 179.917 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 18' ' ' MET . 7.2 mm-40 -88.66 -7.39 56.43 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.499 179.958 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.98 -9.55 68.8 Favored Glycine 0 C--N 1.34 0.793 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.127 -179.114 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.748 ' HB2' ' HA ' ' A' ' 19' ' ' ALA . 68.2 mt -73.07 178.47 4.35 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.508 0.671 . . . . 0.0 111.301 179.92 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.5 t -124.91 172.31 9.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.916 178.755 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.475 ' HB3' ' CG2' ' B' ' 5' ' ' ILE . 0.6 OUTLIER -46.15 -39.8 10.14 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.139 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.689 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 1.3 p -87.87 -50.18 6.61 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.496 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.445 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.4 mt-10 -63.58 -6.32 5.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.624 0.249 . . . . 0.0 110.484 178.96 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.986 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 2.4 tpt -89.73 -50.01 6.31 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-O 122.562 1.173 . . . . 0.0 107.983 178.075 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.084 HG22 HD11 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -73.77 -38.57 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.064 0 CA-C-N 113.202 -1.817 . . . . 0.0 112.444 -178.004 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -61.88 -46.76 88.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 122.091 0.948 . . . . 0.0 108.56 176.684 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.445 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.85 -41.22 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.324 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.219 -179.979 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.69 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -53.36 -34.79 58.98 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.656 178.915 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.862 HD13 HD21 ' B' ' 15' ' ' LEU . 10.3 mt -79.38 -29.07 41.91 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.256 -178.874 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -79.16 -16.98 55.81 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -178.785 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.9 m80 -102.95 2.61 35.34 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.594 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.663 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 1.9 t80 -67.4 -168.95 0.09 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 122.543 0.337 . . . . 0.0 111.078 179.718 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.455 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 C-N-CA 125.866 1.666 . . . . 0.0 112.818 -178.535 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.789 ' HD2' ' CD2' ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.819 0.343 . . . . 0.0 111.145 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.84 130.57 41.37 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.057 0.456 . . . . 0.0 110.941 -179.266 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.4 tp -130.57 142.93 50.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.542 -178.859 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.935 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -127.87 132.84 49.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.739 179.108 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.063 HD12 HG21 ' A' ' 30' ' ' ILE . 0.3 OUTLIER -150.27 -175.28 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.465 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.798 ' O ' HD13 ' B' ' 7' ' ' LEU . 76.6 t-105 -103.79 92.32 4.37 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -177.252 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 1.084 HD11 HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER -128.45 112.9 14.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.412 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.75 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 0.2 OUTLIER -86.35 -164.99 1.13 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -176.764 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -45.27 -66.46 0.4 Allowed 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.067 -1.424 . . . . 0.0 113.691 -178.044 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -47.88 -22.07 0.51 Allowed 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -178.275 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.644 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 28.9 p -101.26 -35.5 9.24 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -178.433 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' B' ' 8' ' ' SER . 55.1 mt -69.7 -41.06 75.91 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 178.475 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -60.91 -41.86 96.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.84 -1.527 . . . . 0.0 107.442 175.858 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.644 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.3 OUTLIER -51.83 -39.28 58.55 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.076 -1.42 . . . . 0.0 110.172 178.367 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.862 HD21 HD13 ' A' ' 34' ' ' LEU . 27.0 mt -78.38 29.91 0.18 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.412 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -104.47 -59.51 1.73 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.435 ' HG3' ' N ' ' B' ' 18' ' ' MET . 6.7 pttm -71.32 -21.73 62.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.72 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.871 ' HB2' ' SD ' ' B' ' 29' ' ' MET . 7.5 mtm -91.17 -18.45 24.44 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.193 -179.866 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.734 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -103.19 -67.15 0.9 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.909 179.101 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.3 mtt-85 -59.98 -66.29 0.54 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 120.914 0.388 . . . . 0.0 112.034 -179.63 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.7 -33.25 15.39 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.956 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' B' ' 18' ' ' MET . 6.8 mm-40 -85.87 -10.83 54.67 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.351 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.58 -10.75 73.64 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.9 -178.681 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.734 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 57.4 mt -71.99 177.26 4.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.606 0.717 . . . . 0.0 111.561 179.779 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 37.5 p -123.44 168.04 13.06 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.46 178.784 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.19 -40.82 5.34 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.357 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.861 ' HA ' HD12 ' A' ' 5' ' ' ILE . 2.2 p -83.68 -51.49 7.22 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.402 ' O ' HG12 ' B' ' 32' ' ' VAL . 2.9 mm-40 -63.64 -7.21 6.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.654 0.264 . . . . 0.0 110.816 178.878 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.871 ' SD ' ' HB2' ' B' ' 18' ' ' MET . 1.7 tpt -89.18 -49.47 6.72 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 177.781 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.92 HG21 HD11 ' A' ' 5' ' ' ILE . 0.6 OUTLIER -72.35 -27.95 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.288 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.696 -178.335 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.444 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -67.83 -52.36 37.75 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.627 0.727 . . . . 0.0 109.785 177.204 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.444 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 10.0 p -63.88 -32.65 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.819 -177.392 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.885 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -49.36 -32.05 10.59 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.892 177.437 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.94 HD13 HD21 ' A' ' 15' ' ' LEU . 14.4 mt -88.72 -26.64 21.68 Favored 'General case' 0 N--CA 1.437 -1.125 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.159 -177.121 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.84 -27.51 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -177.614 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.885 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 6.4 p-80 -89.43 -33.47 16.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.963 0.801 . . . . 0.0 111.022 177.627 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.433 ' HD2' ' SD ' ' A' ' 18' ' ' MET . 20.4 t80 -35.89 144.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.998 0.519 . . . . 0.0 111.877 -179.533 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 2.0 ttpt . . . . . 0 C--O 1.25 1.101 0 C-N-CA 123.611 0.765 . . . . 0.0 112.178 178.938 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.584 ' HB3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 111.652 0.242 . . . . 0.0 111.652 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -71.54 123.57 22.75 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.713 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.504 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.2 tp -122.1 132.66 54.6 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.655 -178.589 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.969 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.0 OUTLIER -117.7 117.92 30.66 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.126 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.888 HD11 HG21 ' B' ' 30' ' ' ILE . 5.5 pt -143.26 176.42 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.827 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.507 ' O ' HD13 ' A' ' 7' ' ' LEU . 74.4 t-105 -98.74 105.25 17.37 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -177.025 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.737 HD11 HG22 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -128.7 123.63 33.57 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.781 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.974 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -86.29 -163.48 0.89 Allowed 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.171 -179.555 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.708 ' O ' HG22 ' A' ' 11' ' ' THR . 3.1 t70 -63.61 -165.14 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.381 -177.949 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.541 ' O ' ' HB ' ' A' ' 11' ' ' THR . 1.7 tt0 36.83 40.68 0.15 Allowed 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.543 0.737 . . . . 0.0 112.761 179.307 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.708 HG22 ' O ' ' A' ' 9' ' ' ASP . 11.2 t 177.39 -51.21 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.274 179.329 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.974 HD23 ' C ' ' A' ' 8' ' ' SER . 0.5 OUTLIER -68.44 -30.19 69.01 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.516 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.78 -40.16 12.66 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 113.745 -1.57 . . . . 0.0 107.706 177.577 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.685 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -44.17 -28.88 0.55 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.803 179.266 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.919 HD21 HD13 ' B' ' 34' ' ' LEU . 34.9 mt -69.2 20.21 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.467 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -97.18 -44.32 6.99 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.674 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HG3' ' HG2' ' A' ' 16' ' ' GLU . 21.7 mtpp -87.73 -26.86 22.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.797 ' HB2' ' SD ' ' A' ' 29' ' ' MET . 7.6 mtm -82.39 -14.5 55.11 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.959 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.774 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -100.63 -64.66 1.02 Allowed 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -179.525 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 -61.53 -69.86 0.22 Allowed 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -178.838 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 13.2 mmp_? -50.38 -29.8 10.84 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.929 -179.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.651 ' HG3' ' HA ' ' A' ' 18' ' ' MET . 4.3 mm-40 -84.57 -26.6 27.86 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -179.639 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.75 67.34 0.95 Allowed Glycine 0 C--N 1.337 0.615 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.771 178.585 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.774 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -176.94 179.5 1.04 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.099 0.475 . . . . 0.0 111.587 177.562 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.452 ' N ' HD23 ' A' ' 24' ' ' LEU . 84.5 p -100.19 165.54 11.44 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.414 -178.791 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.449 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 1.1 mmmm -48.23 -35.72 12.46 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.471 ' O ' HD11 ' B' ' 7' ' ' LEU . 1.5 m -78.55 -58.33 3.3 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 122.239 0.216 . . . . 0.0 110.781 179.88 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.478 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 3.0 mm-40 -57.77 -16.84 12.52 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 178.431 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.797 ' SD ' ' HB2' ' A' ' 18' ' ' MET . 0.8 OUTLIER -75.42 -50.33 16.17 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 122.621 1.2 . . . . 0.0 108.115 177.86 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.79 HG22 HD11 ' B' ' 7' ' ' LEU . 0.3 OUTLIER -70.63 -34.17 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.122 0 CA-C-N 113.007 -1.906 . . . . 0.0 113.069 -177.697 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.456 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.79 -49.03 67.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.046 0.927 . . . . 0.0 108.794 177.023 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.478 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -54.93 -42.1 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.626 -179.702 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.774 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -46.75 -36.15 6.93 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.188 179.367 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.097 HD13 ' CD1' ' B' ' 15' ' ' LEU . 10.5 mt -77.56 -37.1 51.34 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.009 -178.081 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.423 HE22 ' CG ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -71.22 -17.05 62.52 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.484 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -107.02 27.23 9.21 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 177.142 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.745 ' CD1' ' CE1' ' B' ' 36' ' ' HIS . 9.8 t80 -117.08 146.7 42.95 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.667 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.636 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.1 0 C-N-CA 123.74 0.816 . . . . 0.0 112.117 177.475 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.922 ' HB2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.159 0.504 . . . . 0.0 111.944 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -101.87 117.48 34.94 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.953 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.545 HD21 HD11 ' B' ' 5' ' ' ILE . 15.8 tp -108.12 132.88 53.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.531 -177.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.969 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -126.91 119.36 26.55 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.212 178.442 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.7 HD12 HD21 ' B' ' 7' ' ' LEU . 1.0 OUTLIER -152.65 -178.23 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -178.363 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.573 ' C ' HD22 ' B' ' 7' ' ' LEU . 72.1 t-105 -93.49 91.48 7.15 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -177.726 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.79 HD11 HG22 ' A' ' 30' ' ' ILE . 2.1 mm? -128.75 104.14 7.46 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 177.429 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.584 ' HA ' ' HB3' ' A' ' 1' ' ' ARG . 8.8 t -69.66 -135.71 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -176.891 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -90.23 -38.76 13.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -177.631 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . 0.577 ' C ' ' HB2' ' B' ' 14' ' ' ASP . 1.4 mt-30 -73.59 41.83 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.087 0.47 . . . . 0.0 111.717 -179.181 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.736 ' N ' ' HB2' ' B' ' 14' ' ' ASP . 1.1 t -165.27 -37.68 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 178.826 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.416 ' CD2' HD22 ' A' ' 3' ' ' LEU . 15.4 mt -79.87 -42.87 23.33 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.112 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.35 -30.25 22.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.619 177.576 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.736 ' HB2' ' N ' ' B' ' 11' ' ' THR . 5.6 t70 -41.99 -19.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 114.002 -1.454 . . . . 0.0 113.333 -179.052 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.097 ' CD1' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -137.14 56.02 1.8 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 179.272 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.579 ' O ' ' HB2' ' B' ' 20' ' ' ARG . 4.1 mt-10 -56.57 -25.27 51.84 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.929 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.695 ' HA ' ' HB2' ' B' ' 21' ' ' ARG . 9.1 mttp -84.68 -45.07 12.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.948 179.399 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 1.051 ' HE3' ' HG ' ' B' ' 15' ' ' LEU . 20.3 mtm -59.09 -25.89 64.19 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.796 0.331 . . . . 0.0 110.591 179.614 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.7 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -100.91 -64.82 1.01 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.352 179.581 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.579 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 2.9 mtp85 -67.06 -65.14 0.72 Allowed 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.112 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.695 ' HB2' ' HA ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -49.96 -34.33 20.51 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.512 -179.859 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.504 ' HB2' ' O ' ' B' ' 18' ' ' MET . 8.8 mm-40 -82.43 -14.53 54.99 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.017 179.688 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.9 -5.98 83.06 Favored Glycine 0 C--N 1.339 0.707 0 C-N-CA 120.852 -0.69 . . . . 0.0 111.702 -178.546 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.778 HD12 ' O ' ' B' ' 18' ' ' MET . 76.6 mt -71.8 177.57 4.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 121.679 0.752 . . . . 0.0 111.681 179.952 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . 0.485 ' O ' ' HB3' ' B' ' 29' ' ' MET . 25.1 p -119.0 169.33 9.99 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.261 178.418 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.41 -37.66 17.61 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.492 ' HA ' HD12 ' A' ' 5' ' ' ILE . 6.0 p -87.02 -49.76 7.11 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.566 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.459 ' HB3' HD22 ' B' ' 24' ' ' LEU . 2.4 mm-40 -61.12 -11.62 9.45 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 121.046 -0.262 . . . . 0.0 111.019 179.686 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.902 ' HG2' HD21 ' B' ' 15' ' ' LEU . 0.0 OUTLIER -85.28 -43.05 14.08 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 176.748 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.888 HG21 HD11 ' A' ' 5' ' ' ILE . 0.3 OUTLIER -78.99 -24.59 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-N 113.616 -1.629 . . . . 0.0 113.789 -176.942 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.523 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -66.26 -53.92 31.17 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 176.658 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.523 ' N ' ' ND2' ' B' ' 31' ' ' ASN . 15.0 p -64.29 -32.6 58.19 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.673 0 CA-C-N 113.796 -1.547 . . . . 0.0 112.333 -177.69 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.906 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -52.3 -27.97 17.26 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.651 177.195 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.919 HD13 HD21 ' A' ' 15' ' ' LEU . 13.4 mt -90.31 -27.15 19.61 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.416 -178.374 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -69.18 -37.25 78.06 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -178.049 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.906 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 4.5 p-80 -81.77 -41.45 21.16 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 118.952 0.796 . . . . 0.0 110.772 178.309 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 28.3 t80 -48.48 150.24 1.4 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.907 -179.42 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' B' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 117.947 -1.025 . . . . 0.0 112.3 178.172 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.713 ' HD3' ' HA ' ' B' ' 8' ' ' SER . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.096 0.474 . . . . 0.0 111.914 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -110.36 117.21 33.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 177.353 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 1.8 tp -127.8 140.93 51.74 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.725 -177.883 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.923 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -120.73 129.87 53.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.414 178.624 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.612 ' CD1' HG21 ' B' ' 30' ' ' ILE . 0.8 OUTLIER -150.85 -176.94 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.5 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.614 ' C ' HD22 ' A' ' 7' ' ' LEU . 70.9 t-105 -92.69 94.79 9.19 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.591 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.91 HD11 HG22 ' B' ' 30' ' ' ILE . 1.8 mm? -130.36 105.44 7.89 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.3 177.76 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 51.8 p -67.7 -139.18 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.582 0.229 . . . . 0.0 110.941 -178.855 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -99.0 -142.64 0.32 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 119.558 -0.258 . . . . 0.0 111.386 -179.191 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.412 ' O ' ' HB ' ' A' ' 11' ' ' THR . 0.0 OUTLIER 33.38 42.11 0.04 OUTLIER 'General case' 0 C--N 1.346 0.445 0 C-N-CA 123.455 0.702 . . . . 0.0 112.67 179.401 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.678 ' HA ' ' CB ' ' A' ' 14' ' ' ASP . 0.7 OUTLIER -176.34 -49.9 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.989 179.488 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.847 HD22 HD22 ' B' ' 3' ' ' LEU . 47.7 mt -71.22 -39.8 71.49 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 176.016 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.09 -40.44 65.0 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 113.134 -1.848 . . . . 0.0 107.04 176.088 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.678 ' CB ' ' HA ' ' A' ' 11' ' ' THR . 1.2 t70 -49.39 -27.46 4.09 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 113.497 -1.683 . . . . 0.0 110.753 179.108 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.025 HD21 HD13 ' B' ' 34' ' ' LEU . 74.3 mt -63.02 4.52 0.18 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -60.73 -59.04 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 179.49 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.4 pttp -85.76 -9.02 57.76 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.392 178.88 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.594 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 10.7 mtp -88.37 -23.46 23.37 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.944 179.48 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -101.35 -60.62 1.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.567 -179.796 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.6 mtp-105 -63.5 -68.08 0.37 Allowed 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 111.549 -179.716 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.41 -34.16 15.69 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.48 179.909 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.594 ' HB2' ' O ' ' A' ' 18' ' ' MET . 6.6 mm-40 -81.32 -28.2 34.68 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.08 -179.961 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.487 ' O ' ' HB3' ' A' ' 24' ' ' LEU . . . 97.91 68.92 0.95 Allowed Glycine 0 C--N 1.339 0.724 0 C-N-CA 120.394 -0.907 . . . . 0.0 113.135 179.505 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.818 ' CD2' ' HA ' ' A' ' 19' ' ' ALA . 0.0 OUTLIER 177.02 -178.49 0.17 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.153 0.501 . . . . 0.0 111.748 178.146 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.491 ' N ' HD23 ' A' ' 24' ' ' LEU . 0.7 OUTLIER -110.69 166.88 10.66 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.865 -178.696 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.408 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -38.11 -43.29 0.73 Allowed 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -179.271 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.623 ' HB3' ' HB3' ' B' ' 6' ' ' TRP . 4.4 m -78.45 -53.39 7.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 117.733 0.242 . . . . 0.0 111.295 -179.27 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.609 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.5 mt-10 -64.37 -15.2 60.0 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 110.023 178.605 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.697 ' HB2' HD21 ' A' ' 24' ' ' LEU . 2.5 tpt -77.09 -46.93 21.92 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 177.245 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.098 HG21 HD12 ' B' ' 5' ' ' ILE . 0.5 OUTLIER -75.0 -25.92 18.81 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.788 0 CA-C-N 112.834 -1.985 . . . . 0.0 112.716 -178.586 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.562 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -66.44 -51.25 58.87 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.674 0.749 . . . . 0.0 109.241 177.395 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.562 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 12.3 p -66.97 -31.69 54.59 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.679 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.56 -177.866 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.742 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -44.9 -34.07 2.23 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.32 177.406 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.808 HD13 HD21 ' B' ' 15' ' ' LEU . 8.8 mt -95.75 -24.92 16.28 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -177.769 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -69.69 -39.76 76.76 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -177.858 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.742 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.3 OUTLIER -64.12 -34.73 78.71 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 119.237 0.926 . . . . 0.0 110.225 178.247 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.651 ' CD1' ' N ' ' A' ' 38' ' ' LYS . 0.9 OUTLIER -48.83 141.71 7.16 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.298 -0.865 . . . . 0.0 113.076 -179.629 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.651 ' N ' ' CD1' ' A' ' 37' ' ' TYR . 10.7 mmmt . . . . . 0 C--O 1.248 1.025 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 177.193 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 120.899 0.38 . . . . 0.0 111.571 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -79.42 133.79 36.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.859 179.603 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.847 HD22 HD22 ' A' ' 12' ' ' LEU . 2.2 tp -133.41 144.85 49.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.516 -178.647 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.923 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.3 OUTLIER -128.92 130.3 46.61 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.71 179.077 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 1.098 HD12 HG21 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -150.34 -173.86 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -178.579 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.623 ' HB3' ' HB3' ' A' ' 27' ' ' SER . 67.0 t-105 -97.91 101.6 13.14 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -177.485 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.902 HD11 ' CG2' ' A' ' 30' ' ' ILE . 1.6 mm? -128.27 107.0 9.41 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.499 178.113 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.713 ' HA ' ' HD3' ' A' ' 1' ' ' ARG . 11.1 p -79.99 -172.95 3.66 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 121.508 0.671 . . . . 0.0 112.103 -178.492 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -48.96 -58.07 5.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.967 -179.55 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -50.48 -30.79 13.59 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.021 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.663 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 44.2 p -87.57 -34.7 18.47 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.776 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' B' ' 8' ' ' SER . 50.2 mt -68.58 -39.82 80.8 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 178.394 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.11 -41.52 94.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 113.53 -1.668 . . . . 0.0 108.365 176.496 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.663 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.3 OUTLIER -52.57 -46.44 66.87 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.086 179.036 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.808 HD21 HD13 ' A' ' 34' ' ' LEU . 23.9 mt -77.34 32.31 0.15 Allowed 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.97 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -105.64 -55.7 2.29 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.226 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -82.13 -24.77 34.91 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.465 179.214 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.706 ' HE2' HD23 ' B' ' 15' ' ' LEU . 8.0 mtm -85.08 -14.49 47.04 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.688 0.28 . . . . 0.0 110.451 179.294 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.841 ' HA ' HD21 ' B' ' 24' ' ' LEU . . . -99.92 -65.51 0.96 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.026 -179.891 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 22.3 mtp85 -58.56 -63.54 1.25 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.044 0.449 . . . . 0.0 111.502 -179.146 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.46 -34.75 17.59 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.549 179.381 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' B' ' 18' ' ' MET . 3.2 mm-40 -73.22 -28.64 62.28 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.145 178.907 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.65 -15.67 37.82 Favored Glycine 0 C--N 1.339 0.703 0 C-N-CA 121.141 -0.552 . . . . 0.0 113.332 179.663 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.841 HD21 ' HA ' ' B' ' 19' ' ' ALA . 0.0 OUTLIER -90.64 -172.51 3.42 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.197 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 18.1 p -114.28 170.73 8.08 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.699 -179.883 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' B' ' 30' ' ' ILE . 3.1 mttm -44.64 -39.77 5.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.428 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.62 ' O ' HD11 ' A' ' 7' ' ' LEU . 13.2 m -71.94 -62.03 1.57 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.483 0.182 . . . . 0.0 110.906 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.669 ' HB3' ' HB2' ' B' ' 24' ' ' LEU . 2.6 mm-40 -57.95 -17.05 14.54 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.132 179.353 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.743 ' HE3' ' CG2' ' B' ' 32' ' ' VAL . 1.3 tpt -78.07 -45.78 22.61 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 123.601 1.667 . . . . 0.0 107.565 177.466 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.91 HG22 HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -67.73 -18.76 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.403 -2.789 0 CA-C-N 112.845 -1.98 . . . . 0.0 112.21 -177.987 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.435 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.0 OUTLIER -81.71 -44.96 16.37 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.67 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.807 ' HB ' ' CD2' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -60.41 -32.28 50.73 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.659 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 1.02 ' HA ' ' CE1' ' B' ' 36' ' ' HIS . . . -35.74 -40.04 0.17 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 113.656 -1.611 . . . . 0.0 110.967 178.325 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 15' ' ' LEU . 4.0 mt -94.72 -28.38 15.34 Favored 'General case' 0 N--CA 1.432 -1.339 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.259 -179.216 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' B' ' 32' ' ' VAL . 9.9 mt-30 -83.14 -30.13 28.1 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.091 0.774 . . . . 0.0 113.091 -179.375 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 1.02 ' CE1' ' HA ' ' B' ' 33' ' ' ALA . 0.3 OUTLIER -94.3 19.43 9.48 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 117.909 0.322 . . . . 0.0 111.654 179.446 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.731 ' HA ' ' CD2' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -56.48 129.51 41.04 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -179.721 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.701 ' N ' ' HD1' ' B' ' 37' ' ' TYR . 1.4 mmmt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 117.824 -1.084 . . . . 0.0 111.38 176.277 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 111.471 0.175 . . . . 0.0 111.471 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -80.58 113.13 18.56 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.465 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.417 ' O ' ' HA ' ' B' ' 4' ' ' CYS . 2.5 tp -122.95 141.33 52.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.058 -178.161 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.63 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.1 OUTLIER -116.96 128.73 55.49 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.975 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.86 HG13 HD21 ' A' ' 7' ' ' LEU . 1.9 pt -151.57 178.51 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.095 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -91.07 89.79 7.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -177.481 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.86 HD21 HG13 ' A' ' 5' ' ' ILE . 0.7 OUTLIER -120.36 102.54 8.54 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.86 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.2 p -67.62 -140.62 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -177.061 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.406 ' C ' ' H ' ' A' ' 11' ' ' THR . 13.6 t70 -95.28 -38.86 10.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.507 -178.011 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -72.55 39.45 0.08 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 122.946 0.498 . . . . 0.0 112.039 -179.153 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.841 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 9.7 t -163.59 -43.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 179.18 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 7' ' ' LEU . 56.6 mt -68.12 -41.26 81.97 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.214 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -65.05 -38.46 90.91 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 113.416 -1.72 . . . . 0.0 107.917 176.07 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.841 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.5 t70 -51.78 -42.72 62.63 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.996 178.331 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.07 HD21 HD13 ' B' ' 34' ' ' LEU . 50.3 mt -73.31 -12.7 60.93 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.744 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -54.83 -42.31 71.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.62 0.247 . . . . 0.0 110.379 179.903 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -92.93 -20.94 20.12 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.717 179.325 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.916 ' HE2' HD23 ' A' ' 15' ' ' LEU . 30.9 mtm -87.21 -61.31 1.75 Allowed 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -179.3 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 1.016 ' HA ' ' HA3' ' A' ' 23' ' ' GLY . . . -25.18 -34.5 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 114.214 1.191 . . . . 0.0 114.214 -178.48 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 18' ' ' MET . 31.3 mmm-85 -70.21 -113.88 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.797 179.643 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.1 mmm-85 -55.38 -24.42 29.69 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 122.703 0.401 . . . . 0.0 111.875 179.669 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 18' ' ' MET . 26.8 mm-40 -103.63 -19.57 14.3 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -177.85 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 1.037 ' C ' HD13 ' A' ' 24' ' ' LEU . . . -115.36 -9.56 12.9 Favored Glycine 0 C--N 1.341 0.859 0 C-N-CA 119.127 -1.511 . . . . 0.0 114.624 -178.074 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.037 HD13 ' C ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER 44.21 32.43 0.68 Allowed 'General case' 0 CA--C 1.556 1.195 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 177.508 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.697 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 1.9 t 131.68 163.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 127.707 2.403 . . . . 0.0 109.495 177.904 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 26' ' ' LYS . 5.4 mtpt -69.24 -48.18 62.64 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 119.92 -0.712 . . . . 0.0 109.577 179.824 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.412 ' CB ' ' H ' ' B' ' 6' ' ' TRP . 9.6 m -77.95 -30.77 50.56 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.261 178.101 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.896 ' HB3' ' CD2' ' A' ' 24' ' ' LEU . 2.6 mm-40 -73.31 -28.47 62.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.743 179.091 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.974 ' CG ' HD22 ' A' ' 15' ' ' LEU . 3.4 tpt -67.87 -46.08 72.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 123.759 1.742 . . . . 0.0 107.896 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.083 HG22 HD11 ' B' ' 7' ' ' LEU . 0.4 OUTLIER -65.75 -18.45 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.037 0 CA-C-N 112.917 -1.947 . . . . 0.0 111.845 -179.371 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -50.33 11.35 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.144 177.084 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.848 ' HB ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -55.4 -34.47 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.081 0 CA-C-O 121.707 0.765 . . . . 0.0 109.06 178.562 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 1.007 ' HA ' ' CE1' ' A' ' 36' ' ' HIS . . . -35.56 -46.56 0.41 Allowed 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 113.558 -1.655 . . . . 0.0 111.556 178.056 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.998 HD13 ' CD2' ' B' ' 15' ' ' LEU . 6.2 mt -83.5 -32.82 25.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.868 -179.092 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -81.05 -11.74 59.46 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 179.478 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 1.007 ' CE1' ' HA ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -123.29 -4.93 8.34 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -179.529 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.615 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 0.7 OUTLIER -62.6 142.17 58.15 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.847 0.459 . . . . 0.0 110.52 179.88 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 117.863 -1.065 . . . . 0.0 112.262 178.763 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.55 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -73.81 127.3 32.45 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 179.048 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.1 tp -134.48 137.82 44.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.629 -178.869 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.63 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER -111.07 128.54 55.91 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.804 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.995 ' CD1' HG21 ' A' ' 30' ' ' ILE . 4.0 pt -150.62 176.19 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.446 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.577 ' C ' HD22 ' B' ' 7' ' ' LEU . 74.5 t-105 -94.58 104.12 16.06 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -177.612 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 1.083 HD11 HG22 ' A' ' 30' ' ' ILE . 1.3 mm? -124.08 115.48 21.24 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 176.976 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 28.0 p -73.86 -135.91 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -177.637 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' B' ' 13' ' ' GLU . 12.9 t70 -96.49 -39.79 9.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -177.755 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -72.29 41.31 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.72 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.645 ' HA ' ' HB2' ' B' ' 14' ' ' ASP . 4.7 t -160.57 -44.49 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.307 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.415 HD21 ' HB2' ' B' ' 7' ' ' LEU . 17.6 mt -73.79 -41.9 61.74 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.677 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' B' ' 9' ' ' ASP . 1.9 mt-10 -76.32 -37.98 56.63 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 113.555 -1.657 . . . . 0.0 108.366 176.472 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.645 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.5 OUTLIER -48.8 -32.14 8.21 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.227 178.304 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.998 ' CD2' HD13 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -82.13 32.89 0.39 Allowed 'General case' 0 N--CA 1.423 -1.796 0 C-N-CA 124.654 1.182 . . . . 0.0 112.923 179.906 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.557 ' HG2' ' N ' ' B' ' 17' ' ' LYS . 0.1 OUTLIER -81.84 -41.92 20.37 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.995 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.557 ' N ' ' HG2' ' B' ' 16' ' ' GLU . 24.0 mtpp -115.59 24.07 11.85 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.626 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.7 ' SD ' HD22 ' B' ' 15' ' ' LEU . 35.6 mtp -110.83 -75.53 0.62 Allowed 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.397 0.141 . . . . 0.0 111.356 -179.831 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.975 ' HB2' ' CD1' ' B' ' 15' ' ' LEU . . . -25.46 -32.57 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.865 1.666 . . . . 0.0 114.131 -177.913 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' B' ' 18' ' ' MET . 0.0 OUTLIER -62.5 -141.46 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 120.476 -0.489 . . . . 0.0 109.699 177.944 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.468 ' N ' ' CG ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -43.43 -21.94 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.577 -0.702 . . . . 0.0 112.279 179.043 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' B' ' 20' ' ' ARG . 19.5 mm-40 -104.42 -12.93 16.28 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -177.769 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.731 ' HA3' ' HA ' ' B' ' 19' ' ' ALA . . . -137.71 12.26 3.69 Favored Glycine 0 CA--C 1.501 -0.79 0 C-N-CA 116.804 -2.617 . . . . 0.0 116.962 -175.713 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' B' ' 19' ' ' ALA . 1.1 mp 53.55 -161.97 0.12 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 119.723 1.762 . . . . 0.0 112.622 177.038 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 1.5 m -64.14 158.85 21.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.438 178.895 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.48 -43.14 11.37 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 117.624 0.193 . . . . 0.0 111.509 -179.608 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -82.69 -50.28 8.89 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.883 -0.144 . . . . 0.0 111.078 179.569 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.48 ' O ' ' HB ' ' B' ' 32' ' ' VAL . 2.2 mm-40 -54.07 -30.12 46.91 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.799 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.867 ' SD ' HD21 ' B' ' 15' ' ' LEU . 3.5 tpt -60.39 -47.58 85.45 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 122.82 1.295 . . . . 0.0 109.821 177.603 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.737 HG22 HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -79.28 -29.47 13.67 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.43 0 CA-C-N 112.407 -2.179 . . . . 0.0 114.056 -175.341 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' B' ' 32' ' ' VAL . 0.1 OUTLIER -70.58 -48.16 56.64 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.297 1.046 . . . . 0.0 108.931 177.079 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' B' ' 28' ' ' GLU . 2.1 t -58.96 -47.07 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-N 112.869 -1.969 . . . . 0.0 111.469 -179.304 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.873 ' HB1' ' O ' ' A' ' 33' ' ' ALA . . . -45.18 -34.81 2.91 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.804 179.686 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 1.07 HD13 HD21 ' A' ' 15' ' ' LEU . 13.6 mt -83.78 -30.46 26.58 Favored 'General case' 0 N--CA 1.44 -0.932 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.398 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -80.36 -9.19 59.74 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.951 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -120.43 25.86 9.54 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 120.71 0.29 . . . . 0.0 111.153 177.961 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.596 ' CD1' ' CG ' ' A' ' 36' ' ' HIS . 22.1 t80 -132.96 163.55 28.94 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.744 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.595 ' N ' ' CG ' ' B' ' 37' ' ' TYR . 3.5 tppt? . . . . . 0 C--O 1.247 0.922 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.137 178.757 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 120.211 0.053 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -79.69 120.17 23.63 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.998 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.479 HD13 ' HA ' ' A' ' 3' ' ' LEU . 2.7 mm? -131.48 153.63 49.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.494 -178.995 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.894 ' SG ' ' SG ' ' B' ' 4' ' ' CYS . 0.8 OUTLIER -126.65 127.56 45.37 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.329 178.829 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.838 HD11 HG21 ' B' ' 30' ' ' ILE . 2.7 pt -145.32 176.49 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.446 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.483 ' C ' HD22 ' A' ' 7' ' ' LEU . 73.3 t-105 -96.2 95.06 7.87 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -177.156 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.799 HD21 HD12 ' A' ' 5' ' ' ILE . 1.3 mm? -124.9 108.23 11.69 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.298 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.0 p -72.37 -136.79 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.535 0.207 . . . . 0.0 111.07 -178.867 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.681 ' O ' HG22 ' A' ' 11' ' ' THR . 1.7 t70 -88.14 -156.46 0.36 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 119.798 -0.144 . . . . 0.0 110.932 -179.535 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.15 44.1 0.09 Allowed 'General case' 0 C--N 1.346 0.413 0 C-N-CA 123.229 0.611 . . . . 0.0 112.089 179.24 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.697 ' HA ' ' HB2' ' A' ' 14' ' ' ASP . 7.8 t -172.65 -46.45 0.02 OUTLIER 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.714 179.673 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.741 HD21 ' HB2' ' A' ' 7' ' ' LEU . 34.5 mt -73.57 -42.58 61.44 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 175.774 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.96 -39.61 83.34 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 113.323 -1.762 . . . . 0.0 107.081 175.657 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.697 ' HB2' ' HA ' ' A' ' 11' ' ' THR . 1.9 t70 -49.46 -30.69 8.53 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.015 -1.448 . . . . 0.0 110.415 178.581 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.988 HD21 HD13 ' B' ' 34' ' ' LEU . 45.6 mt -73.51 22.73 0.07 Allowed 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 179.703 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -83.85 -66.1 0.93 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 122.17 -0.332 . . . . 0.0 110.551 179.835 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.75 -15.22 60.3 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.712 179.528 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.792 ' CE ' HD23 ' A' ' 15' ' ' LEU . 15.7 mtm -87.1 -27.37 23.16 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.37 -179.861 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.82 ' HA ' ' CD2' ' A' ' 24' ' ' LEU . . . -102.13 -59.38 1.71 Allowed 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.354 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.15 -62.21 1.93 Allowed 'General case' 0 CA--C 1.513 -0.475 0 CA-C-O 120.902 0.382 . . . . 0.0 111.601 -179.171 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.52 -36.15 22.36 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.513 179.439 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 18' ' ' MET . 12.1 mm-40 -76.21 -26.89 56.55 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.467 179.03 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.23 -12.85 61.93 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.18 -0.533 . . . . 0.0 112.359 -179.177 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.85 HD21 ' HB2' ' A' ' 29' ' ' MET . 0.0 OUTLIER -85.14 178.95 7.35 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.922 0.391 . . . . 0.0 111.9 -179.466 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.657 ' N ' HD23 ' A' ' 24' ' ' LEU . 19.3 p -113.76 169.6 8.87 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.779 -178.655 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.533 ' O ' ' HB ' ' A' ' 30' ' ' ILE . 0.0 OUTLIER -37.48 -42.4 0.51 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -179.385 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.692 ' CB ' ' HB3' ' B' ' 6' ' ' TRP . 29.2 p -72.42 -62.46 1.43 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 122.363 0.265 . . . . 0.0 111.586 -179.644 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . 3.1 mm-40 -58.56 -13.16 5.04 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.594 179.074 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.85 ' HB2' HD21 ' A' ' 24' ' ' LEU . 2.6 tpt -82.39 -48.25 11.35 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-O 122.736 1.255 . . . . 0.0 108.302 178.311 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.702 HD13 HD21 ' B' ' 34' ' ' LEU . 0.6 OUTLIER -74.51 -36.24 40.97 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.106 0 CA-C-N 112.806 -1.997 . . . . 0.0 112.916 -177.696 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.45 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -64.18 -47.04 81.37 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 122.136 0.969 . . . . 0.0 108.75 176.864 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 28' ' ' GLU . 0.9 OUTLIER -59.96 -42.3 89.02 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 113.239 -1.801 . . . . 0.0 111.422 -179.584 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.746 ' CB ' HD23 ' B' ' 34' ' ' LEU . . . -50.82 -42.27 58.26 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.443 179.622 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.877 HD13 HD23 ' B' ' 15' ' ' LEU . 9.4 mt -73.76 -34.32 64.65 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.617 -178.037 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -74.46 -13.57 60.72 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.181 0.438 . . . . 0.0 112.181 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -107.85 -40.1 5.36 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 177.983 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.623 ' HB2' ' HA ' ' B' ' 33' ' ' ALA . 2.4 t80 -29.33 133.02 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.038 0.535 . . . . 0.0 111.963 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HB3' ' HE3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.852 -0.594 . . . . 0.0 112.058 178.147 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 1' ' ' ARG . . . . . 0.475 ' HB3' ' O ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 . . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 94.3 m95 -78.97 122.37 26.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 178.963 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 2.8 mm? -130.57 152.5 49.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.334 -179.271 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 4' ' ' CYS . . . . . 0.894 ' SG ' ' SG ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -125.67 128.31 47.63 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.532 178.956 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.492 ' CD1' HG21 ' A' ' 30' ' ' ILE . 2.3 pp -151.21 169.45 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-O 121.037 0.446 . . . . 0.0 112.118 -178.801 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.692 ' HB3' ' CB ' ' A' ' 27' ' ' SER . 68.4 t-105 -81.19 90.51 6.08 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.74 0.781 . . . . 0.0 111.29 -179.594 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.637 ' HG ' HG23 ' B' ' 11' ' ' THR . 12.7 tp -107.17 95.39 5.68 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 178.537 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.57 ' O ' ' HG ' ' B' ' 12' ' ' LEU . 6.0 p -81.34 -157.94 0.19 Allowed 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -175.96 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -66.08 -41.57 90.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.913 -178.125 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 10' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -74.33 42.28 0.15 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 121.147 0.499 . . . . 0.0 111.346 -179.54 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . 0.722 ' OG1' HD12 ' A' ' 34' ' ' LEU . 9.5 t -167.83 -43.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -179.822 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' B' ' 8' ' ' SER . 28.1 mt -69.9 -41.65 74.41 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 176.26 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' B' ' 16' ' ' GLU . 2.7 mt-10 -73.97 -41.35 62.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.37 -1.741 . . . . 0.0 108.187 176.582 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . 0.639 ' HB2' ' HA ' ' B' ' 11' ' ' THR . 0.6 OUTLIER -49.07 -27.31 3.25 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.091 178.519 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 1.033 HD11 ' SD ' ' B' ' 29' ' ' MET . 0.2 OUTLIER -81.57 40.56 0.59 Allowed 'General case' 0 N--CA 1.424 -1.759 0 C-N-CA 124.134 0.974 . . . . 0.0 112.385 179.883 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' B' ' 13' ' ' GLU . 7.1 mt-10 -74.59 -66.82 0.69 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.475 179.823 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -107.89 33.39 4.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.231 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 18' ' ' MET . . . . . 0.643 ' HB2' HD13 ' B' ' 15' ' ' LEU . 3.2 mtm -105.36 -84.52 0.5 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 122.322 -0.236 . . . . 0.0 110.684 179.679 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.758 ' HA ' ' HB2' ' B' ' 24' ' ' LEU . . . -48.49 -49.27 36.45 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.26 0.624 . . . . 0.0 111.693 179.873 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -61.33 -65.4 0.7 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.156 0.503 . . . . 0.0 111.26 -179.639 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.5 -32.52 27.79 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.28 179.368 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.527 ' HB2' ' O ' ' B' ' 18' ' ' MET . 18.5 mm-40 -91.22 -6.8 52.84 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.718 -179.686 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.22 4.45 68.54 Favored Glycine 0 C--N 1.338 0.683 0 C-N-CA 120.295 -0.955 . . . . 0.0 111.666 -178.03 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.758 ' HB2' ' HA ' ' B' ' 19' ' ' ALA . 97.1 mt -78.92 169.48 18.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.501 0.667 . . . . 0.0 111.174 179.911 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 92.5 p -112.24 161.06 17.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.477 178.036 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.38 -37.14 0.96 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.48 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.5 m -83.26 -58.12 2.97 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.644 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -59.09 -13.85 8.2 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 120.957 0.408 . . . . 0.0 110.496 178.944 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 1.033 ' SD ' HD11 ' B' ' 15' ' ' LEU . 3.3 tpt -80.76 -47.17 14.3 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-O 122.679 1.228 . . . . 0.0 108.494 178.059 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.838 HG21 HD11 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -75.94 -28.97 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.206 0 CA-C-N 112.794 -2.003 . . . . 0.0 113.219 -177.319 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.456 ' HB2' HD12 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -68.2 -48.55 64.9 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 122.329 1.062 . . . . 0.0 108.668 177.105 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.408 ' N ' HD22 ' B' ' 31' ' ' ASN . 2.2 t -56.97 -48.28 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.577 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.794 -179.533 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . 0.762 ' CB ' HD23 ' A' ' 34' ' ' LEU . . . -47.76 -38.49 15.61 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.49 179.051 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.988 HD13 HD21 ' A' ' 15' ' ' LEU . 11.6 mt -74.67 -31.07 61.81 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.957 -178.04 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -82.69 -13.82 55.7 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.111 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 16.2 m80 -124.78 21.66 8.3 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.786 0.327 . . . . 0.0 111.4 177.889 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.558 ' CE2' ' HB3' ' A' ' 18' ' ' MET . 0.6 OUTLIER -81.1 131.79 35.32 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.66 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.458 ' HB3' ' HE3' ' B' ' 38' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.121 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 178.347 . . . . . . . . 2 2 . 1 stop_ save_