data_2k6t_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 2k6t _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.465 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.52 -0.179 0 CA-C-O 121.164 0.507 . . . . 0.0 110.999 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -77.62 -48.77 16.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.855 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.465 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.91 -46.41 71.44 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.138 -179.468 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -74.55 -24.44 58.94 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.802 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.558 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.9 t -63.14 -40.55 97.9 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.787 0.327 . . . . 0.0 110.999 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.4 mt -80.9 -45.0 17.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.821 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 32.5 t -108.31 -53.89 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.41 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 126.03 167.86 12.54 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.621 -179.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 68.1 m -140.64 138.73 34.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.41 ' C ' ' N ' ' A' ' 123' ' ' GLN . 82.0 p -81.24 160.2 24.34 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.376 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.722 ' HA ' HG21 ' B' ' 45' ' ' VAL . 7.2 mt-30 -54.31 -17.64 3.18 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.415 ' O ' HG23 ' A' ' 127' ' ' THR . 44.9 mt-30 -71.27 -55.92 7.08 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.574 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -53.01 -56.01 19.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.866 -0.791 . . . . 0.0 108.866 178.435 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.472 ' HB3' ' HA ' ' B' ' 42' ' ' LEU . 1.2 mp -57.95 -32.18 67.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.028 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 7.0 mt -63.99 -28.3 69.71 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 120.837 0.351 . . . . 0.0 110.24 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -102.0 -2.6 29.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.722 -179.618 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 59.0 mt . . . . . 0 N--CA 1.45 -0.475 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.379 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.451 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.6 pt-20 . . . . . 0 CA--C 1.512 -0.511 0 CA-C-O 121.499 0.666 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -62.6 107.09 0.88 Allowed 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.676 -177.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.701 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 24.6 mt -97.59 95.74 7.82 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.692 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.558 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 33.9 m -92.31 85.96 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.576 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.88 -78.41 0.01 OUTLIER Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.776 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.476 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 5.9 t-160 -63.5 -54.18 40.41 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 117.074 0.437 . . . . 0.0 111.161 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.45 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 12.0 m-70 -52.37 -42.84 64.31 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 176.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.701 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 35.1 t80 -62.84 -28.81 70.28 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 112.579 -2.1 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.538 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.5 t -71.85 -66.9 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.415 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.9 OUTLIER -46.15 -59.12 3.08 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 119.374 -0.346 . . . . 0.0 110.641 178.844 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.535 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -51.3 -49.5 61.16 Favored 'General case' 0 C--O 1.213 -0.864 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.249 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.671 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.47 -38.62 4.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.381 0.61 . . . . 0.0 110.035 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.538 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -78.05 -65.7 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.332 179.345 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 6.1 mtt180 -32.87 -42.42 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 122.473 1.13 . . . . 0.0 109.94 177.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.722 HG21 ' HA ' ' A' ' 122' ' ' GLN . 58.8 t -74.67 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.105 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.3 t . . . . . 0 CA--C 1.514 -0.436 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.631 -176.179 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.403 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.248 0.547 . . . . 0.0 109.905 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.46 -24.3 56.95 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.491 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.472 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -62.89 -58.16 8.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.184 179.185 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.597 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -71.85 -29.61 64.57 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.437 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.626 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -57.45 -34.86 69.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.006 0.431 . . . . 0.0 110.479 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.9 mt -79.58 -59.67 2.65 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.891 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.3 m -105.14 -39.45 6.2 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 113.0 157.59 12.87 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.418 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 73.1 m -127.69 148.12 50.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.26 0.553 . . . . 0.0 112.424 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.448 ' OG1' ' HB2' ' A' ' 123' ' ' GLN . 12.5 p -84.76 165.7 17.59 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.334 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.75 ' HA ' HG21 ' B' ' 45' ' ' VAL . 11.1 mt-30 -65.27 0.09 1.56 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.408 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.448 ' HB2' ' OG1' ' A' ' 121' ' ' THR . 23.4 mt-30 -92.06 -53.49 4.23 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.207 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.572 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.64 -54.22 46.83 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.374 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.547 ' HB2' HG13 ' B' ' 45' ' ' VAL . 1.1 mt -57.47 -33.19 67.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.487 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 5.5 mt -62.85 -28.31 69.94 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.996 0.427 . . . . 0.0 110.205 178.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -98.07 -4.29 36.23 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.382 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 50.8 mt . . . . . 0 N--CA 1.449 -0.491 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.626 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.741 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.2 pt-20 . . . . . 0 CA--C 1.515 -0.387 0 CA-C-O 121.167 0.508 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -60.06 112.03 1.73 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.961 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.744 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.8 mt -106.14 99.05 8.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.528 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.626 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -100.23 96.73 7.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.137 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.49 -83.16 0.01 OUTLIER Glycine 0 C--N 1.321 -0.285 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.966 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.446 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 4.4 t-160 -64.43 -54.14 37.25 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.241 0.52 . . . . 0.0 111.475 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.43 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.5 m-70 -53.59 -39.06 64.55 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.744 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.5 t80 -65.47 -27.94 68.86 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 112.916 -1.947 . . . . 0.0 109.77 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.529 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.6 t -74.22 -68.01 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.388 -0.824 . . . . 0.0 108.847 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.402 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.4 OUTLIER -43.79 -57.83 3.04 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 123.25 0.344 . . . . 0.0 111.086 179.379 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.471 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -52.78 -51.82 59.13 Favored 'General case' 0 C--O 1.212 -0.893 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.301 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.625 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.33 -39.64 3.21 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.279 0.561 . . . . 0.0 110.476 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.529 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -76.22 -64.57 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.073 179.29 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -34.45 -41.84 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.523 1.154 . . . . 0.0 110.051 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.75 HG21 ' HA ' ' A' ' 122' ' ' GLN . 68.3 t -73.78 -65.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 112.768 -2.014 . . . . 0.0 113.38 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 11.2 t . . . . . 0 CA--C 1.514 -0.436 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.603 -176.419 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.223 0 CA-C-O 121.076 0.465 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 25.5 ttt180 -77.86 -51.6 10.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.183 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.49 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -51.91 -35.94 47.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.649 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 74.3 m -79.0 -30.67 44.4 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 112.04 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.64 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.5 t -56.89 -45.46 82.57 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.574 -0.451 . . . . 0.0 110.006 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 19.5 mt -81.03 -38.94 26.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.316 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.5 t -106.66 -72.7 0.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.649 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.36 156.79 8.97 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.729 ' SG ' HD11 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -113.24 159.68 19.08 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.709 0.766 . . . . 0.0 112.233 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.478 ' C ' ' H ' ' A' ' 123' ' ' GLN . 64.0 p -95.78 155.29 16.81 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.293 178.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.656 ' HA ' HG21 ' B' ' 45' ' ' VAL . 20.5 mt-30 -60.25 -3.28 0.59 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.496 ' O ' HG23 ' A' ' 127' ' ' THR . 47.6 mt-30 -87.86 -56.37 3.37 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.574 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.8 t70 -53.1 -54.33 37.15 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.613 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.2 mt -56.94 -35.01 68.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.321 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.459 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.0 mt -64.07 -25.54 68.15 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-O 120.822 0.344 . . . . 0.0 110.162 178.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.2 p -97.14 -6.76 34.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.483 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 29.0 mt . . . . . 0 N--CA 1.452 -0.348 0 CA-C-O 120.886 0.374 . . . . 0.0 110.536 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.605 ' HG3' HD21 ' B' ' 33' ' ' LEU . 11.8 pt-20 . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 121.628 0.728 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.99 112.4 2.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.183 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.768 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 31.4 mt -112.74 107.29 15.88 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.695 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -101.84 81.12 2.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.53 0.681 . . . . 0.0 111.206 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.425 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 65.09 -81.97 0.07 OUTLIER Glycine 0 C--N 1.321 -0.294 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.932 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -58.0 -56.08 26.61 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 117.315 0.558 . . . . 0.0 110.871 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -52.59 -46.53 66.97 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.768 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 24.7 t80 -54.26 -31.01 52.53 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.187 -1.824 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.603 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.2 t -72.83 -52.49 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.438 ' NE ' HG11 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -51.53 -65.04 0.63 Allowed 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.61 0.569 . . . . 0.0 110.912 179.421 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.516 ' HB2' HD13 ' B' ' 33' ' ' LEU . . . -50.32 -45.88 55.09 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.653 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -47.05 -40.89 15.82 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.255 0.55 . . . . 0.0 109.813 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.603 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.6 OUTLIER -73.48 -65.13 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.029 178.342 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.425 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.8 mtt180 -34.0 -41.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.086 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.656 HG21 ' HA ' ' A' ' 122' ' ' GLN . 78.5 t -74.5 -60.37 2.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 113.417 -1.72 . . . . 0.0 112.447 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.2 t . . . . . 0 CA--C 1.514 -0.437 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.68 -176.313 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.455 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.518 -0.255 0 CA-C-O 121.367 0.604 . . . . 0.0 109.713 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -77.18 -24.95 51.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.194 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.483 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -63.83 -54.91 27.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.473 179.382 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.546 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.7 m -74.82 -14.13 60.65 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.586 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.603 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.0 t -76.91 -28.16 55.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.032 0.444 . . . . 0.0 110.075 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.0 mt -81.11 -34.44 32.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.699 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 m -138.33 -36.09 0.59 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.406 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 118.36 171.74 15.34 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.763 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.483 ' HB2' HD11 ' B' ' 33' ' ' LEU . 71.2 m -140.58 138.38 34.41 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.287 0.565 . . . . 0.0 112.463 -179.379 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 74.2 p -77.25 157.88 30.58 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.501 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.7 ' HA ' HG21 ' B' ' 45' ' ' VAL . 15.8 mt-30 -53.57 -20.63 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.41 ' O ' HG23 ' A' ' 127' ' ' THR . 21.7 mt-30 -70.53 -54.02 13.82 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.572 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -53.94 -53.03 58.45 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 178.258 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.456 HD22 ' N ' ' B' ' 42' ' ' LEU . 1.1 mt -61.12 -30.72 70.54 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.629 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 7.0 mt -63.44 -27.17 69.1 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.41 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.5 OUTLIER -92.38 -16.0 26.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.902 179.759 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 14.5 mt . . . . . 0 N--CA 1.446 -0.638 0 CA-C-O 121.561 0.696 . . . . 0.0 109.267 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.552 ' HG3' HD21 ' B' ' 33' ' ' LEU . 11.8 pt-20 . . . . . 0 CA--C 1.514 -0.417 0 CA-C-O 121.42 0.628 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.403 ' HA ' ' CA ' ' A' ' 119' ' ' GLY . 13.9 mtpt -63.16 108.2 1.21 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.625 -178.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.756 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 9.7 mt -101.91 98.86 9.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.959 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.603 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.7 t -99.83 94.09 6.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.251 0.548 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.11 -83.4 0.02 OUTLIER Glycine 0 C--N 1.321 -0.264 0 CA-C-N 115.029 -0.987 . . . . 0.0 112.991 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -60.19 -57.3 13.38 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.91 0.355 . . . . 0.0 111.493 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 8.2 m170 -52.96 -44.73 67.35 Favored 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.756 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 20.2 t80 -57.7 -28.99 64.32 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.897 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.529 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.0 OUTLIER -74.15 -60.22 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.145 177.815 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.462 ' HG3' HH11 ' B' ' 40' ' ' ARG . 0.5 OUTLIER -49.43 -64.34 0.84 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 119.414 -0.327 . . . . 0.0 110.632 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.525 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -46.05 -49.23 16.55 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.498 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.615 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.56 -41.0 6.16 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.322 0.582 . . . . 0.0 110.431 179.883 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.529 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -79.84 -59.74 2.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.489 179.595 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -36.22 -39.37 0.18 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.104 0.954 . . . . 0.0 109.335 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.7 HG21 ' HA ' ' A' ' 122' ' ' GLN . 59.8 t -76.02 -53.17 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 113.538 -1.664 . . . . 0.0 111.387 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 45.6 t . . . . . 0 N--CA 1.45 -0.433 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.271 -177.004 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.449 0 CA-C-O 121.682 0.753 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.07 -34.34 59.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.335 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.43 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -62.19 -29.26 70.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.334 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.635 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 60.3 m -84.01 -33.91 24.42 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.813 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.6 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.6 t -54.9 -35.5 64.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 44.2 mt -82.4 -53.72 5.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.453 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 58.3 m -106.91 -58.46 1.93 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.635 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 128.64 174.22 13.67 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.372 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.591 ' SG ' HD13 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -133.13 155.17 49.77 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.376 0.588 . . . . 0.0 111.701 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.538 ' C ' ' H ' ' A' ' 123' ' ' GLN . 67.8 p -97.71 159.94 14.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.524 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.723 ' HA ' HG23 ' B' ' 45' ' ' VAL . 16.3 mt-30 -62.13 2.67 0.22 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.538 ' H ' ' C ' ' A' ' 121' ' ' THR . 19.9 mt-30 -94.92 -57.01 2.56 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 2.7 m-20 -55.41 -51.0 68.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.581 ' HB2' HG13 ' B' ' 45' ' ' VAL . 1.2 mt -59.04 -34.73 72.25 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.097 179.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.464 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.4 mt -63.24 -30.35 71.51 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.745 0.307 . . . . 0.0 110.796 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -94.43 -5.46 46.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.519 -179.613 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 95.5 mt . . . . . 0 N--CA 1.452 -0.342 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.799 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.608 ' HG3' HD21 ' B' ' 33' ' ' LEU . 11.9 pt-20 . . . . . 0 CA--C 1.515 -0.393 0 CA-C-O 121.526 0.679 . . . . 0.0 111.892 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 118' ' ' SER . 81.6 mttt -65.64 109.59 2.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.204 -1.362 . . . . 0.0 112.799 -177.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.747 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 58.7 mt -105.78 96.61 6.61 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.537 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.6 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.8 t -92.23 84.44 5.22 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.351 -179.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 63.11 -77.79 0.03 OUTLIER Glycine 0 C--N 1.32 -0.35 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.976 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.459 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 3.9 t-160 -65.1 -52.46 55.3 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.32 0.56 . . . . 0.0 111.054 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.544 ' HB3' HD22 ' B' ' 33' ' ' LEU . 11.6 m170 -55.23 -35.32 64.81 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.747 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 47.0 t80 -69.5 -26.42 64.53 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 113.007 -1.906 . . . . 0.0 109.664 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.497 ' O ' HG21 ' B' ' 43' ' ' VAL . 2.3 t -73.71 -68.33 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 176.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.459 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 2.4 mpt_? -43.76 -55.11 4.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.525 0.516 . . . . 0.0 110.942 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.484 ' O ' ' CG2' ' B' ' 45' ' ' VAL . . . -56.12 -49.35 74.15 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.084 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.678 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -45.45 -40.88 8.8 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.469 0.652 . . . . 0.0 110.104 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.497 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -71.18 -62.02 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.907 178.903 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.473 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.9 mtt180 -38.68 -38.33 0.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.337 1.065 . . . . 0.0 109.759 177.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.723 HG23 ' HA ' ' A' ' 122' ' ' GLN . 58.5 t -76.18 -63.38 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 113.072 -1.877 . . . . 0.0 114.024 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 CA--C 1.514 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.54 -176.01 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.455 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.517 -0.305 0 CA-C-O 121.403 0.62 . . . . 0.0 109.617 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.65 -26.0 50.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.474 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.452 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -63.16 -56.24 18.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.571 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.596 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -72.98 -29.17 62.85 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.791 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.628 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.5 t -57.44 -37.58 73.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.729 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 14.3 mt -79.58 -56.44 4.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.833 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.9 m -105.27 -43.16 5.07 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 115.01 160.67 12.92 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.386 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 73.9 m -131.21 148.17 52.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.307 0.575 . . . . 0.0 112.534 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.508 ' HG1' ' HB2' ' A' ' 123' ' ' GLN . 12.3 p -85.44 164.47 17.86 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.038 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.71 ' HA ' HG21 ' B' ' 45' ' ' VAL . 40.8 mt-30 -63.11 -3.68 1.9 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.213 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.508 ' HB2' ' HG1' ' A' ' 121' ' ' THR . 11.8 mm-40 -87.87 -54.28 4.32 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.582 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.49 -54.07 48.47 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.389 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.557 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.1 mt -57.46 -32.8 67.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.533 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.466 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.8 mt -64.13 -27.99 69.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.852 0.358 . . . . 0.0 110.11 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.414 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -94.9 -7.35 40.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.232 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 34.5 mt . . . . . 0 N--CA 1.449 -0.48 0 CA-C-O 120.759 0.314 . . . . 0.0 110.521 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.74 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.1 pt-20 . . . . . 0 CA--C 1.516 -0.344 0 CA-C-O 121.211 0.529 . . . . 0.0 110.201 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -62.73 112.58 2.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.923 -177.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.754 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 4.8 mt -106.42 99.68 9.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.421 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.628 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -99.98 98.74 9.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.395 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 56.66 -83.27 0.01 OUTLIER Glycine 0 C--N 1.322 -0.242 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.057 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.426 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.3 t-160 -63.4 -55.14 26.78 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 117.281 0.541 . . . . 0.0 111.439 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -53.06 -42.84 66.21 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.754 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 19.7 t80 -60.09 -30.58 69.34 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.001 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.658 HG11 ' HE ' ' B' ' 40' ' ' ARG . 1.4 t -72.76 -64.2 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.658 ' HE ' HG11 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -42.71 -62.63 0.95 Allowed 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 123.617 0.573 . . . . 0.0 110.634 179.065 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.495 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -51.0 -52.72 40.0 Favored 'General case' 0 C--O 1.21 -0.975 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.233 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.62 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.79 -38.81 3.43 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.042 0.448 . . . . 0.0 110.439 -179.88 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.587 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -76.98 -64.4 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.055 179.058 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 -33.83 -43.56 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.468 1.128 . . . . 0.0 110.136 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.71 HG21 ' HA ' ' A' ' 122' ' ' GLN . 57.3 t -72.47 -58.86 4.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 112.799 -2.001 . . . . 0.0 112.676 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.5 t . . . . . 0 C--N 1.325 -0.46 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.508 -176.181 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.466 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 121.237 0.541 . . . . 0.0 110.417 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -21.35 52.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.566 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.447 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -71.02 -51.29 26.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.983 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.56 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.4 m -74.56 -19.09 60.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.113 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.632 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.3 t -71.12 -48.58 51.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.786 0.326 . . . . 0.0 111.164 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.1 mt -80.85 -15.08 57.3 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 47.8 t -134.44 -52.73 0.82 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.407 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 115.69 147.78 9.12 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.448 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 95.4 m -122.67 140.7 52.56 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.431 ' HG1' ' H ' ' A' ' 124' ' ' ASP . 75.3 p -76.72 155.51 33.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.756 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.684 ' HA ' HG21 ' B' ' 45' ' ' VAL . 20.2 mt-30 -55.15 -20.25 9.75 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.447 ' O ' ' HB2' ' A' ' 126' ' ' LEU . 6.9 mp0 -69.84 -51.83 30.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.6 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -54.63 -57.11 12.72 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.019 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.489 ' HB3' ' HA ' ' B' ' 42' ' ' LEU . 1.1 mt -56.21 -30.75 62.75 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.64 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.2 mt -62.88 -31.71 72.81 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.069 0.461 . . . . 0.0 109.847 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.54 -1.44 35.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.707 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 72.7 mt . . . . . 0 N--CA 1.45 -0.442 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.129 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.55 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.3 tp10 . . . . . 0 CA--C 1.51 -0.577 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 60.4 mttt -68.14 101.99 1.26 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.431 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.734 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.5 mt -99.91 98.44 9.22 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.42 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.632 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.9 t -98.71 94.57 6.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.167 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.49 -80.6 0.01 OUTLIER Glycine 0 C--N 1.32 -0.357 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.901 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.482 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 3.5 t-160 -65.98 -55.24 17.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.184 0.492 . . . . 0.0 111.494 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.439 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -53.14 -36.85 61.28 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 177.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.734 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.9 t80 -67.72 -29.22 68.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 112.988 -1.914 . . . . 0.0 109.822 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.53 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.5 t -73.11 -65.61 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.387 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.9 OUTLIER -48.34 -58.6 4.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 119.204 -0.426 . . . . 0.0 110.934 179.221 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.44 ' O ' ' CG2' ' B' ' 45' ' ' VAL . . . -50.53 -47.07 57.69 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.519 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.616 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.17 -39.24 13.35 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.205 0.526 . . . . 0.0 110.275 179.582 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.53 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -79.76 -62.48 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.382 179.697 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mtt180 -32.25 -40.8 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.437 1.113 . . . . 0.0 108.866 176.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.684 HG21 ' HA ' ' A' ' 122' ' ' GLN . 91.2 t -74.93 -66.43 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 112.949 -1.932 . . . . 0.0 112.215 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 47.7 t . . . . . 0 CA--C 1.513 -0.455 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.057 -175.848 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.156 0 CA-C-O 121.292 0.568 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -77.49 -52.3 9.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.334 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.428 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -54.8 -31.59 59.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.732 -178.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.642 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 68.1 m -79.92 -22.18 43.03 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.956 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.622 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.8 t -70.6 -33.94 71.6 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.4 mt -84.12 -24.72 30.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.155 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.464 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 78.1 p -136.58 -63.04 0.64 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.753 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.642 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.21 156.11 8.76 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.761 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.644 ' HB2' HD11 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -107.96 155.85 19.87 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 121.666 0.746 . . . . 0.0 112.213 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.465 ' C ' ' H ' ' A' ' 123' ' ' GLN . 32.7 p -94.84 151.27 19.37 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.441 178.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.621 ' HA ' HG21 ' B' ' 45' ' ' VAL . 9.9 mt-30 -56.56 -8.07 0.5 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.465 ' H ' ' C ' ' A' ' 121' ' ' THR . 3.9 mm100 -83.46 -54.96 4.58 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.537 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 1.7 t70 -54.27 -54.71 36.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.644 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.1 mt -56.67 -34.01 66.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.431 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.9 mt -62.89 -29.57 70.87 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.919 0.39 . . . . 0.0 110.572 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.75 -2.08 36.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.386 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 72.0 mt . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 120.727 0.299 . . . . 0.0 110.694 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 4.7 tp10 . . . . . 0 CA--C 1.512 -0.509 0 CA-C-O 121.234 0.54 . . . . 0.0 111.265 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 118' ' ' SER . 4.0 mtpm? -63.24 100.02 0.21 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.62 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.762 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 63.4 mt -100.24 102.25 13.48 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.826 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.622 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.1 t -98.14 76.86 2.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.361 0.6 . . . . 0.0 111.223 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.27 -75.61 0.5 Allowed Glycine 0 C--N 1.319 -0.373 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.857 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.436 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 5.2 t-160 -66.63 -53.17 37.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.496 0.648 . . . . 0.0 110.841 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.485 ' HB3' HD22 ' B' ' 33' ' ' LEU . 10.5 m170 -53.7 -38.17 63.99 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.762 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 37.8 t80 -64.75 -30.25 71.26 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.037 -1.892 . . . . 0.0 109.835 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.534 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.5 t -71.09 -66.32 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.423 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.2 mpt_? -46.26 -61.35 1.82 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 119.38 -0.343 . . . . 0.0 110.408 178.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.535 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -48.35 -50.14 31.61 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.513 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.664 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -45.16 -41.56 8.21 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.3 0.571 . . . . 0.0 110.067 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.534 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -74.81 -64.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.191 179.165 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 5.5 mtt180 -33.28 -41.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 122.289 1.042 . . . . 0.0 109.86 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.621 HG21 ' HA ' ' A' ' 122' ' ' GLN . 59.3 t -74.05 -58.54 4.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 113.277 -1.783 . . . . 0.0 112.561 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . 0.403 ' HB2' ' HA ' ' A' ' 126' ' ' LEU . 22.2 t . . . . . 0 CA--C 1.515 -0.382 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.277 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.315 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.84 -18.8 53.43 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.951 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.438 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -72.55 -56.25 5.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.857 -179.585 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.582 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -74.35 -21.73 59.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.904 0.383 . . . . 0.0 110.923 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.646 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.7 t -68.99 -47.85 64.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.9 0.381 . . . . 0.0 110.903 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.2 mt -81.8 -17.5 47.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.287 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 t -132.21 -54.79 0.97 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.471 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 116.95 149.21 9.02 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.509 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 78.0 m -127.22 146.28 50.47 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.505 ' C ' ' H ' ' A' ' 123' ' ' GLN . 65.9 p -87.23 165.06 15.97 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.833 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.791 ' HA ' HG21 ' B' ' 45' ' ' VAL . 14.3 mt-30 -61.68 -0.59 0.46 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 177.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.505 ' H ' ' C ' ' A' ' 121' ' ' THR . 79.7 mt-30 -89.85 -54.37 4.08 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 176.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.509 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -57.99 -50.12 74.5 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.473 ' HB2' HG13 ' B' ' 45' ' ' VAL . 1.1 mp -60.48 -31.72 70.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.24 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.438 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.2 mt -64.55 -28.43 69.64 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 120.961 0.41 . . . . 0.0 110.007 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.58 -5.57 42.3 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.501 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 44.5 mt . . . . . 0 N--CA 1.449 -0.477 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.175 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.626 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.2 tp10 . . . . . 0 CA--C 1.51 -0.589 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 57.6 mttt -65.92 102.42 0.78 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.565 0.698 . . . . 0.0 112.133 -178.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.739 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.0 mt -103.94 100.38 10.16 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.581 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.646 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -99.9 92.28 5.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.88 -80.25 0.02 OUTLIER Glycine 0 C--N 1.322 -0.235 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.889 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.467 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 4.1 t-160 -65.19 -55.66 17.32 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 117.337 0.568 . . . . 0.0 111.182 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.439 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.7 m-70 -52.95 -37.53 61.15 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.739 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 25.4 t80 -67.14 -27.94 67.72 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.02 -1.9 . . . . 0.0 109.786 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.522 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.0 OUTLIER -74.46 -65.77 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.226 177.496 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.467 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.2 mpt_? -46.01 -57.97 3.97 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 119.385 -0.341 . . . . 0.0 110.848 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.467 ' O ' ' CG2' ' B' ' 45' ' ' VAL . . . -52.0 -51.74 55.26 Favored 'General case' 0 C--O 1.212 -0.914 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.975 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.629 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -42.45 -38.06 1.79 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.281 0.562 . . . . 0.0 110.473 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.522 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.3 OUTLIER -77.31 -64.78 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.1 179.073 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.437 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 5.0 mtt180 -34.21 -40.8 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 122.464 1.126 . . . . 0.0 109.767 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.791 HG21 ' HA ' ' A' ' 122' ' ' GLN . 60.8 t -74.51 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.778 -179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.0 t . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.538 -176.307 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 121.448 0.642 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.6 mmm180 -78.51 -23.86 46.1 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.911 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.462 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -70.08 -51.21 33.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.773 179.958 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.552 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 4.5 m -75.49 -16.03 60.35 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.679 -0.409 . . . . 0.0 110.957 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.633 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.9 t -71.57 -53.02 15.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.857 0.361 . . . . 0.0 111.272 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.8 mt -79.84 -13.94 59.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.338 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.7 t -129.29 -55.63 1.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.424 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 114.4 144.11 8.5 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 89.8 m -122.03 142.59 50.17 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.41 ' OG1' ' HB2' ' A' ' 123' ' ' GLN . 73.3 p -75.81 157.05 33.88 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.648 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.656 ' HA ' HG21 ' B' ' 45' ' ' VAL . 18.2 mt-30 -58.83 -14.46 8.92 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.435 ' O ' ' HB2' ' A' ' 126' ' ' LEU . 26.6 mt-30 -74.31 -51.96 13.65 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.61 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.4 OUTLIER -52.66 -57.39 10.22 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.977 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.583 HD13 ' HA ' ' A' ' 122' ' ' GLN . 1.1 mt -54.36 -34.43 61.14 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.488 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 123' ' ' GLN . 6.3 mt -60.76 -32.94 72.22 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.184 0.516 . . . . 0.0 110.001 178.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.429 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -90.94 -9.46 46.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.631 -179.565 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 27.5 mt . . . . . 0 N--CA 1.45 -0.456 0 CA-C-O 120.965 0.412 . . . . 0.0 110.069 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.515 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 5.5 tp10 . . . . . 0 CA--C 1.511 -0.528 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -67.42 101.84 1.03 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.387 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.701 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.2 mt -97.26 96.68 8.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.324 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.633 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -97.66 88.7 4.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.049 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.451 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 64.22 -78.23 0.05 OUTLIER Glycine 0 C--N 1.318 -0.426 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.639 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.554 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 5.6 t-160 -66.37 -54.42 24.7 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 117.336 0.568 . . . . 0.0 111.659 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.479 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 6.8 m-70 -54.51 -34.26 61.35 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.701 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 27.3 t80 -71.68 -27.04 62.78 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.167 -1.833 . . . . 0.0 109.654 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.554 ' HB ' ' HA ' ' B' ' 36' ' ' HIS . 2.3 t -73.61 -62.53 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.615 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.409 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.2 OUTLIER -60.72 -42.48 97.35 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.022 179.272 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.472 ' HB2' HD22 ' A' ' 125' ' ' LEU . . . -61.03 -40.85 95.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.438 1.017 . . . . 0.0 109.225 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.6 -47.02 67.21 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.125 0.488 . . . . 0.0 111.28 179.834 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.51 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.1 OUTLIER -76.09 -49.24 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.174 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.443 ' C ' ' HD3' ' B' ' 44' ' ' ARG . 0.0 OUTLIER -43.91 -40.58 4.67 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-O 122.864 1.316 . . . . 0.0 107.764 177.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.656 HG21 ' HA ' ' A' ' 122' ' ' GLN . 56.0 t -74.05 -62.66 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.195 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . 0.431 ' HB2' HD21 ' A' ' 126' ' ' LEU . 49.1 t . . . . . 0 N--CA 1.451 -0.422 0 CA-C-N 113.917 -1.492 . . . . 0.0 111.927 -176.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.52 -0.184 0 CA-C-O 121.254 0.549 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.7 OUTLIER -78.3 -35.15 48.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.879 178.901 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.489 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -59.97 -56.66 18.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.135 179.842 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.543 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 9.3 m -69.38 -16.41 63.51 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.287 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.625 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -71.34 -46.72 59.9 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.599 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 9.0 mt -80.58 -16.59 53.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 80.5 p -133.68 -51.48 0.85 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.409 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 117.98 160.85 11.75 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.521 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.433 ' HB2' HD11 ' B' ' 33' ' ' LEU . 92.1 m -136.89 143.46 43.0 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 82.3 p -80.82 161.29 24.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.554 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.748 ' HA ' HG21 ' B' ' 45' ' ' VAL . 27.8 mt-30 -58.28 -15.17 9.17 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.446 ' O ' HG23 ' A' ' 127' ' ' THR . 25.5 mt-30 -73.77 -54.68 7.49 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.583 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -54.45 -55.33 29.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.848 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.481 HD23 HD13 ' B' ' 33' ' ' LEU . 1.1 mp -58.83 -31.08 68.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.965 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 6.8 mt -64.77 -27.6 69.01 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.866 0.365 . . . . 0.0 110.158 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -97.94 -6.52 32.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.266 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 40.7 mt . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.748 0.309 . . . . 0.0 110.702 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.559 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.0 tp10 . . . . . 0 CA--C 1.513 -0.461 0 CA-C-O 120.994 0.426 . . . . 0.0 110.399 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -64.65 102.54 0.58 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.793 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.736 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 34.2 mt -99.58 104.88 16.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.14 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.625 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.6 OUTLIER -103.26 95.31 6.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.447 0.641 . . . . 0.0 111.124 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.432 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 58.97 -87.66 0.02 OUTLIER Glycine 0 C--O 1.227 -0.299 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.17 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.494 ' HD2' HG11 ' B' ' 39' ' ' VAL . 18.7 t-160 -59.02 -56.63 19.8 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 117.206 0.503 . . . . 0.0 111.597 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -48.74 -48.78 40.38 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.736 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 22.6 t80 -55.94 -31.28 62.8 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 112.994 -1.912 . . . . 0.0 110.424 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.564 ' O ' HG21 ' B' ' 43' ' ' VAL . 0.5 OUTLIER -72.79 -45.04 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.787 178.189 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' B' ' 36' ' ' HIS . 1.9 mtt180 -61.09 -61.03 2.87 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.879 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.513 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -52.68 -45.56 66.88 Favored 'General case' 0 C--O 1.208 -1.098 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.583 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -45.84 -38.65 7.53 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.349 0.595 . . . . 0.0 109.724 179.433 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.564 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.4 OUTLIER -76.72 -63.41 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.4 178.79 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtm180 -36.7 -40.62 0.27 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.439 1.114 . . . . 0.0 110.195 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.748 HG21 ' HA ' ' A' ' 122' ' ' GLN . 99.4 t -75.19 -65.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 112.949 -1.932 . . . . 0.0 113.4 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.613 -176.053 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 120.948 0.404 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.5 OUTLIER -76.89 -40.5 47.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.654 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.458 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -59.83 -34.82 73.58 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.811 -179.39 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.703 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 73.5 m -77.5 -21.05 53.35 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.071 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.607 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.3 t -65.41 -43.4 90.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 20.9 mt -84.29 -20.71 31.69 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.215 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 43.2 t -127.53 -75.86 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 111.364 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.703 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 132.76 155.03 7.73 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.124 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.646 ' SG ' HD11 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -114.48 149.75 35.87 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.538 0.685 . . . . 0.0 112.273 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.403 ' C ' ' N ' ' A' ' 123' ' ' GLN . 39.0 p -87.89 150.86 23.24 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.051 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.701 ' HA ' HG21 ' B' ' 45' ' ' VAL . 24.3 mt-30 -53.06 -19.22 2.58 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.476 ' O ' ' HB2' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -72.55 -53.61 11.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.488 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 6.0 t70 -55.1 -52.18 64.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.595 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.1 mt -59.01 -31.9 69.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.856 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.5 ' N ' HG12 ' B' ' 45' ' ' VAL . 7.7 mt -63.3 -28.94 70.36 Favored 'General case' 0 C--O 1.231 0.095 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.052 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.09 -3.89 36.97 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.376 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 31.1 mt . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 120.759 0.314 . . . . 0.0 110.444 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.504 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.3 pt-20 . . . . . 0 CA--C 1.511 -0.555 0 CA-C-O 121.62 0.724 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 118' ' ' SER . 79.8 mttt -60.19 104.94 0.36 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.288 -1.324 . . . . 0.0 112.604 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.753 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 63.9 mt -101.33 98.79 9.12 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.186 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.607 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.3 t -94.9 78.32 3.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.388 0.613 . . . . 0.0 111.19 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 67.43 -75.15 0.2 Allowed Glycine 0 C--N 1.32 -0.319 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.744 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.482 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.5 t-160 -65.81 -52.23 52.35 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 117.237 0.519 . . . . 0.0 110.912 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.517 ' HB3' HD22 ' B' ' 33' ' ' LEU . 10.8 m170 -55.44 -36.99 67.11 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 176.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.753 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 39.4 t80 -67.21 -27.3 67.14 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 112.987 -1.915 . . . . 0.0 109.683 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.486 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.6 t -73.13 -66.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-N 115.118 -0.947 . . . . 0.0 108.811 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.443 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 2.5 mpt_? -48.65 -59.64 3.37 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 119.267 -0.396 . . . . 0.0 110.461 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.458 ' O ' ' CG2' ' B' ' 45' ' ' VAL . . . -48.45 -43.81 34.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.805 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.65 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.94 -42.85 65.84 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 121.033 0.444 . . . . 0.0 110.332 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.486 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -74.45 -59.5 3.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.128 179.214 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mmm180 -33.56 -40.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.437 1.113 . . . . 0.0 108.504 176.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.701 HG21 ' HA ' ' A' ' 122' ' ' GLN . 75.0 t -75.84 -65.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 112.997 -1.91 . . . . 0.0 111.751 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 31.8 t . . . . . 0 N--CA 1.449 -0.49 0 CA-C-N 114.225 -1.352 . . . . 0.0 111.671 -176.398 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.403 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.516 -0.353 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.06 -16.46 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.979 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.409 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -73.25 -46.1 52.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.599 179.643 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.563 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.2 m -83.06 -20.64 34.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.391 . . . . 0.0 110.825 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.652 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.4 t -69.72 -50.31 44.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.6 mt -80.95 -14.88 57.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.024 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 27.2 t -131.91 -59.23 0.95 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.493 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.3 147.48 7.89 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 -178.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 94.4 m -123.06 145.0 48.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 39.9 p -82.21 157.91 23.77 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.742 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.648 ' HA ' HG21 ' B' ' 45' ' ' VAL . 7.0 mt-30 -56.85 -18.61 13.67 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.447 ' O ' HG23 ' A' ' 127' ' ' THR . 47.2 mt-30 -72.15 -52.07 18.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.56 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.3 OUTLIER -54.62 -57.01 13.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.471 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.483 ' HB3' ' HA ' ' B' ' 42' ' ' LEU . 1.3 mp -59.26 -28.87 67.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.144 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.417 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 7.1 mt -66.79 -27.01 67.23 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.857 0.36 . . . . 0.0 110.084 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.447 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -100.95 -3.73 28.96 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.354 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 28.2 mt . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.854 0.359 . . . . 0.0 110.369 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.585 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.2 tp10 . . . . . 0 CA--C 1.509 -0.621 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -69.86 102.74 2.02 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.688 0.756 . . . . 0.0 111.612 -178.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.738 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.2 mt -100.91 101.59 12.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.386 -1.279 . . . . 0.0 111.743 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.652 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -98.6 91.25 5.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.305 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.72 -79.5 0.01 OUTLIER Glycine 0 C--N 1.321 -0.258 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.914 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.453 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 3.4 t-160 -63.6 -54.94 28.08 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.106 0.453 . . . . 0.0 111.191 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -54.96 -38.31 67.6 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.738 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 26.5 t80 -65.25 -26.99 68.34 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.062 -1.881 . . . . 0.0 109.626 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.542 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.4 t -74.38 -65.11 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.452 ' O ' ' HG3' ' B' ' 44' ' ' ARG . 0.1 OUTLIER -43.69 -62.37 1.12 Allowed 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 123.259 0.349 . . . . 0.0 110.721 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.558 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -50.54 -50.85 52.27 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 119.807 -0.757 . . . . 0.0 109.032 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.657 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -42.39 -38.93 2.02 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.374 0.607 . . . . 0.0 110.267 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.542 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.3 OUTLIER -78.59 -67.58 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.272 178.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 10.0 mtt180 -32.26 -42.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 122.396 1.093 . . . . 0.0 110.35 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.648 HG21 ' HA ' ' A' ' 122' ' ' GLN . 92.5 t -73.04 -59.87 2.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 113.106 -1.861 . . . . 0.0 112.924 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 13.5 t . . . . . 0 CA--C 1.513 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.137 -176.202 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.397 0.618 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -79.83 -54.11 6.14 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.409 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.461 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -50.61 -32.06 17.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.144 -179.489 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.584 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 72.7 m -85.42 -34.66 21.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.568 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.59 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.0 t -51.11 -36.43 40.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.223 0.535 . . . . 0.0 109.602 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 75.6 mt -81.41 -59.0 2.79 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.245 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.8 m -101.59 -57.03 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.836 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.584 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 124.39 163.14 11.61 Favored Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.624 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.709 ' SG ' HD11 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -111.86 167.98 9.94 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.453 0.644 . . . . 0.0 111.432 179.802 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 123' ' ' GLN . 42.3 p -103.44 155.28 18.62 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 114.755 -1.111 . . . . 0.0 109.496 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.715 ' HA ' HG21 ' B' ' 45' ' ' VAL . 31.2 mt-30 -58.84 -5.75 0.66 Allowed 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.55 HE21 HD12 ' A' ' 126' ' ' LEU . 1.4 mp0 -88.42 -51.78 5.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.582 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t70 -55.01 -56.2 22.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.655 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.1 mt -56.01 -32.05 63.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.714 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.55 HD12 HE21 ' A' ' 123' ' ' GLN . 5.8 mt -62.7 -30.59 71.51 Favored 'General case' 0 CA--C 1.524 -0.053 0 CA-C-O 121.028 0.442 . . . . 0.0 110.191 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.42 -5.25 40.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.559 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 31.9 mt . . . . . 0 N--CA 1.45 -0.428 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.992 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.627 ' HG3' HD21 ' B' ' 33' ' ' LEU . 10.9 pt-20 . . . . . 0 CA--C 1.514 -0.439 0 CA-C-O 121.592 0.71 . . . . 0.0 110.936 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 82.0 mttt -55.54 117.5 3.64 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.322 -1.308 . . . . 0.0 112.478 -178.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.773 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 21.4 mt -116.93 100.91 8.08 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.183 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.59 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 83.2 m -95.79 76.78 3.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.27 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.477 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.34 -81.98 0.2 Allowed Glycine 0 C--O 1.229 -0.193 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.842 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.532 ' O ' ' HG3' ' B' ' 40' ' ' ARG . 11.3 t-160 -60.27 -53.41 57.99 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 117.285 0.542 . . . . 0.0 110.725 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.574 ' HA ' ' HE ' ' B' ' 40' ' ' ARG . 13.1 m-70 -52.58 -45.13 66.33 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.773 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 24.2 t80 -56.03 -29.36 60.3 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 113.104 -1.862 . . . . 0.0 109.85 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.574 ' O ' HG21 ' B' ' 43' ' ' VAL . 0.9 OUTLIER -73.09 -57.63 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.387 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.574 ' HE ' ' HA ' ' B' ' 37' ' ' HIS . 23.9 mtm180 -44.92 -66.7 0.36 Allowed 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.159 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.516 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -51.08 -46.5 61.8 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.655 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.82 -39.11 17.43 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.265 0.555 . . . . 0.0 109.792 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.574 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.7 OUTLIER -73.22 -65.03 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.95 178.238 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.4 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 2.1 mtt180 -34.94 -41.04 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.165 177.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.715 HG21 ' HA ' ' A' ' 122' ' ' GLN . 66.5 t -74.46 -61.86 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 113.34 -1.755 . . . . 0.0 112.89 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.515 -0.391 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.368 -176.285 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.098 0.475 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -77.1 -48.41 17.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.926 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.442 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -55.22 -30.58 60.27 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.095 -179.248 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.597 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 70.7 m -84.01 -29.0 27.3 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.19 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.606 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 51.4 t -54.94 -42.73 72.67 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.0 mt -81.51 -46.48 14.43 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.926 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.0 m -102.92 -74.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.1 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.597 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 135.1 156.93 7.84 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.589 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.667 ' HB2' HD11 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -108.46 168.07 9.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.522 0.677 . . . . 0.0 111.765 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.459 ' C ' ' H ' ' A' ' 123' ' ' GLN . 26.9 p -107.69 158.67 17.08 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.696 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.704 ' HA ' HG21 ' B' ' 45' ' ' VAL . 30.4 mt-30 -62.57 -2.38 1.07 Allowed 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.459 ' H ' ' C ' ' A' ' 121' ' ' THR . 27.1 mt-30 -90.65 -57.07 2.95 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 176.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.516 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.5 OUTLIER -54.44 -53.39 54.82 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.304 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.667 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.2 mt -56.05 -36.37 67.96 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.789 178.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.579 HD22 ' HB2' ' B' ' 46' ' ' CYS . 5.6 mt -62.27 -31.06 71.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 120.974 0.416 . . . . 0.0 109.942 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -90.19 -7.72 52.91 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.47 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.56 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.4 mt . . . . . 0 N--CA 1.449 -0.477 0 CA-C-O 121.148 0.499 . . . . 0.0 109.984 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.605 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.0 pt-20 . . . . . 0 CA--C 1.509 -0.613 0 CA-C-O 121.515 0.674 . . . . 0.0 110.846 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.524 ' HZ1' ' HB3' ' B' ' 32' ' ' LYS . 4.6 mtpm? -60.4 106.58 0.55 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.394 -1.276 . . . . 0.0 112.421 -177.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.749 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 60.1 mt -106.14 98.19 7.91 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.945 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.606 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.6 m -93.22 71.05 4.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.214 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.425 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.7 -75.18 0.57 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.443 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.526 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 7.8 t-160 -64.27 -51.35 63.98 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 117.133 0.466 . . . . 0.0 110.569 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.506 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 13.2 m-70 -56.13 -39.18 71.85 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.749 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 38.4 t80 -63.46 -26.4 68.71 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.216 179.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.538 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.6 t -74.57 -67.28 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.79 176.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.433 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.7 OUTLIER -45.37 -58.47 3.3 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.207 0.317 . . . . 0.0 110.51 178.898 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.529 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -50.1 -51.86 39.5 Favored 'General case' 0 C--O 1.214 -0.81 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.58 -44.67 8.98 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.313 0.578 . . . . 0.0 110.465 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.538 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -69.34 -62.65 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.898 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -35.56 -39.83 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.849 -1.068 . . . . 0.0 109.684 177.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.704 HG21 ' HA ' ' A' ' 122' ' ' GLN . 57.3 t -74.13 -58.19 5.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.904 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . 0.579 ' HB2' HD22 ' A' ' 126' ' ' LEU . 39.5 t . . . . . 0 CA--C 1.512 -0.498 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.853 -177.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 120.944 0.402 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.9 mmt180 -77.38 -45.29 26.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.954 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.13 -28.49 64.72 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.956 -179.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.659 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 98.7 m -84.68 -24.09 29.12 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.9 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.64 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.6 t -60.57 -45.18 94.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.96 -40.84 23.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.498 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.8 t -101.68 -78.45 0.53 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.391 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.659 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.2 147.35 6.32 Favored Glycine 0 C--O 1.228 -0.261 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.732 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.624 ' SG ' HD11 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -109.85 142.4 41.2 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.081 0.467 . . . . 0.0 110.86 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.7 p -72.01 -91.12 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 122.333 1.063 . . . . 0.0 111.453 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.622 ' HA ' HG21 ' B' ' 45' ' ' VAL . 9.7 mt-30 -156.28 -30.64 0.09 Allowed 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.986 -1.915 . . . . 0.0 108.546 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.446 ' O ' HG23 ' A' ' 127' ' ' THR . 49.3 mt-30 -63.66 -49.08 74.61 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.532 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 31.5 t70 -57.05 -56.46 21.44 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.564 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.1 mt -58.3 -25.33 61.73 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.76 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.426 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 11.2 mt -71.77 -30.87 66.04 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.874 0.369 . . . . 0.0 110.338 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -92.1 -7.28 49.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.232 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 24.1 mt . . . . . 0 N--CA 1.449 -0.498 0 CA-C-O 120.763 0.316 . . . . 0.0 110.919 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.596 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 10.1 tp10 . . . . . 0 CA--C 1.51 -0.563 0 CA-C-O 121.303 0.573 . . . . 0.0 111.713 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 76.7 mttt -63.27 102.23 0.38 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.912 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.746 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 60.4 mt -101.16 102.37 13.28 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.911 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.3 t -97.84 76.0 2.42 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.412 0.625 . . . . 0.0 111.355 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.419 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.35 -73.91 0.56 Allowed Glycine 0 C--N 1.319 -0.416 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.678 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.464 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.2 t-160 -67.73 -52.86 32.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 117.142 0.471 . . . . 0.0 111.002 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.531 ' HB3' HD22 ' B' ' 33' ' ' LEU . 10.7 m170 -54.58 -36.22 64.15 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 176.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.746 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 41.7 t80 -66.67 -29.62 69.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 112.96 -1.927 . . . . 0.0 109.517 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.509 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.9 t -71.88 -68.25 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.305 -0.861 . . . . 0.0 108.694 177.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.446 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.2 mpt_? -45.53 -56.7 4.81 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 119.523 -0.275 . . . . 0.0 110.316 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.549 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -51.31 -51.61 52.72 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.078 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.641 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.14 -46.53 5.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.413 0.625 . . . . 0.0 110.303 179.852 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.509 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -68.76 -64.71 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.179 179.101 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -34.08 -41.64 0.11 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.249 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.622 HG21 ' HA ' ' A' ' 122' ' ' GLN . 71.5 t -74.26 -60.22 2.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 113.304 -1.771 . . . . 0.0 112.682 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.522 -176.188 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.318 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 2.3 mpp_? -77.29 -20.96 54.29 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.405 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -65.4 -41.68 93.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.981 179.028 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.567 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 2.2 m -92.72 -22.65 19.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.09 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.598 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.1 t -65.02 -36.26 83.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.913 0.387 . . . . 0.0 110.516 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.68 -46.34 15.73 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.856 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 31.7 m -117.37 -44.64 2.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.402 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 119.84 163.72 12.34 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.557 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.404 ' O ' HD11 ' B' ' 33' ' ' LEU . 81.9 m -134.08 139.04 45.7 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.354 0.597 . . . . 0.0 112.321 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 58.8 p -75.41 154.01 37.37 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.695 179.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.651 ' HA ' HG21 ' B' ' 45' ' ' VAL . 13.4 mt-30 -53.38 -19.9 3.95 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.624 HE21 HD12 ' A' ' 126' ' ' LEU . 8.3 mm-40 -68.98 -52.77 25.48 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.522 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.24 -54.01 48.79 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.392 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.514 ' HB3' ' HA ' ' B' ' 42' ' ' LEU . 1.4 mp -59.55 -29.87 68.22 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.451 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.624 HD12 HE21 ' A' ' 123' ' ' GLN . 7.5 mt -64.04 -29.97 71.07 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 178.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.36 -0.28 35.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.408 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 52.0 mt . . . . . 0 N--CA 1.451 -0.414 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.667 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.546 ' HG3' HD21 ' B' ' 33' ' ' LEU . 11.6 pt-20 . . . . . 0 CA--C 1.515 -0.4 0 CA-C-O 121.104 0.478 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -61.31 108.15 0.88 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.179 -0.919 . . . . 0.0 113.168 -177.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.727 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.3 mt -103.87 96.8 6.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.896 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.598 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 5.0 t -96.27 90.56 5.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.36 0.6 . . . . 0.0 111.254 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.428 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.71 -78.71 0.02 OUTLIER Glycine 0 C--N 1.321 -0.255 0 CA-C-N 114.849 -1.069 . . . . 0.0 112.973 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.48 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 3.5 t-160 -66.06 -52.62 47.29 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.449 0.624 . . . . 0.0 111.215 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.457 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 4.4 m-70 -55.82 -35.64 66.57 Favored 'General case' 0 CA--C 1.501 -0.906 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 177.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.727 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 28.2 t80 -68.86 -26.73 65.29 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 112.962 -1.926 . . . . 0.0 109.433 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.497 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.4 t -74.17 -67.12 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.852 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.452 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.6 mpt_? -44.74 -61.6 1.52 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.627 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.459 ' HA ' ' HG3' ' B' ' 44' ' ' ARG . . . -49.43 -45.76 46.86 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 119.861 -0.735 . . . . 0.0 109.548 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.3 OUTLIER -49.78 -41.16 43.65 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.065 0.46 . . . . 0.0 110.346 179.507 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.497 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -75.79 -61.67 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.292 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.459 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 5.2 mtt180 -33.19 -41.48 0.07 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.547 1.165 . . . . 0.0 108.853 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.651 HG21 ' HA ' ' A' ' 122' ' ' GLN . 82.5 t -74.99 -68.57 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-N 112.871 -1.968 . . . . 0.0 112.621 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 8.5 t . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.866 -175.99 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.486 0.66 . . . . 0.0 109.722 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -78.77 -26.24 44.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.182 178.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.485 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -70.54 -55.25 9.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.966 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.557 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 10.0 m -68.89 -24.4 64.32 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.242 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.625 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 38.0 t -61.3 -52.89 62.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.813 0.339 . . . . 0.0 111.15 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.0 mt -79.2 -34.72 42.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.056 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 m -106.4 -59.88 1.73 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.49 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.72 162.14 11.65 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.508 ' HB2' HD11 ' B' ' 33' ' ' LEU . 73.2 m -143.02 147.09 34.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.799 0.799 . . . . 0.0 112.882 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.538 ' HG1' ' HB2' ' A' ' 123' ' ' GLN . 29.5 p -87.64 169.78 11.84 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.005 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.761 ' HA ' HG21 ' B' ' 45' ' ' VAL . 28.5 mt-30 -66.63 3.46 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.368 178.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.538 ' HB2' ' HG1' ' A' ' 121' ' ' THR . 25.3 mt-30 -94.31 -54.83 3.4 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.552 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -56.33 -53.4 57.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.574 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.594 ' HB2' HG13 ' B' ' 45' ' ' VAL . 1.0 OUTLIER -56.75 -33.09 66.23 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.32 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.481 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.7 mt -66.78 -35.52 80.28 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.067 0.46 . . . . 0.0 110.033 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.455 HG23 ' O ' ' A' ' 123' ' ' GLN . 5.3 p -82.97 -5.89 59.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.463 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.586 HD12 ' HA ' ' A' ' 125' ' ' LEU . 50.3 mt . . . . . 0 N--CA 1.446 -0.653 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.823 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.784 ' HG3' HD21 ' B' ' 33' ' ' LEU . 10.3 pt-20 . . . . . 0 CA--C 1.518 -0.268 0 CA-C-O 121.321 0.582 . . . . 0.0 110.466 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -62.93 113.27 2.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.862 -1.063 . . . . 0.0 113.22 -177.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.784 HD21 ' HG3' ' B' ' 31' ' ' GLU . 6.7 mt -110.19 99.7 8.72 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.842 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.625 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.9 OUTLIER -99.03 95.32 7.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.298 0.57 . . . . 0.0 111.354 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.413 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 59.95 -82.42 0.01 OUTLIER Glycine 0 C--N 1.321 -0.254 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.18 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.472 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.0 t-160 -66.21 -51.64 55.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.273 0.536 . . . . 0.0 111.501 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.411 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -54.0 -39.7 66.3 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 176.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.748 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 22.4 t80 -64.39 -28.91 70.01 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 112.692 -2.049 . . . . 0.0 109.597 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.545 ' O ' HG21 ' B' ' 43' ' ' VAL . 2.2 t -72.58 -69.74 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.8 OUTLIER -41.06 -57.57 2.0 Allowed 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 123.382 0.426 . . . . 0.0 111.258 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.472 ' O ' ' CG2' ' B' ' 45' ' ' VAL . . . -55.44 -50.24 70.33 Favored 'General case' 0 C--O 1.21 -0.987 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.408 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.69 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -46.5 -35.91 6.18 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.271 0.558 . . . . 0.0 110.749 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.545 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.5 OUTLIER -77.51 -61.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.849 178.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 3.6 mmm180 -37.29 -40.37 0.34 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 122.622 1.201 . . . . 0.0 109.493 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.761 HG21 ' HA ' ' A' ' 122' ' ' GLN . 47.4 t -79.31 -71.22 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 112.607 -2.088 . . . . 0.0 114.108 -178.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.518 -0.252 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.789 -176.006 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 121.211 0.529 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -77.59 -36.62 51.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.833 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.463 ' CZ ' ' SG ' ' A' ' 120' ' ' CYS . 0.0 OUTLIER -65.54 -36.92 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.365 -179.494 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.544 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 13.5 m -83.15 -22.85 33.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.21 178.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.593 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 40.6 t -61.35 -54.04 48.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.315 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.5 mt -79.3 -32.51 43.53 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 70.7 m -105.5 -61.61 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.409 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 121.13 154.12 9.19 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 -178.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 124' ' ' ASP . 92.1 m -133.78 139.58 46.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.436 ' OG1' ' HB2' ' A' ' 123' ' ' GLN . 43.2 p -73.99 160.36 31.43 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.868 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.716 ' HA ' HG21 ' B' ' 45' ' ' VAL . 18.5 mt-30 -57.61 -16.98 12.01 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.436 ' HB2' ' OG1' ' A' ' 121' ' ' THR . 6.3 mt-30 -70.55 -52.11 23.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.572 ' HB3' ' HB3' ' A' ' 120' ' ' CYS . 7.9 t70 -54.0 -54.36 40.11 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.504 ' HB3' ' HA ' ' B' ' 42' ' ' LEU . 1.1 mt -58.82 -31.14 68.2 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.776 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.6 mt -64.79 -27.6 69.0 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 109.895 178.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -91.45 -16.46 27.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.291 -179.821 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 17.1 mt . . . . . 0 N--CA 1.449 -0.515 0 CA-C-O 121.339 0.59 . . . . 0.0 109.865 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 6.4 tp10 . . . . . 0 CA--C 1.51 -0.59 0 CA-C-O 121.266 0.555 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.8 103.63 1.16 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.301 -179.168 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.74 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 26.9 mt -98.67 97.1 8.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.713 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.593 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.2 m -95.48 78.13 3.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.297 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.43 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.05 -80.49 0.19 Allowed Glycine 0 C--O 1.228 -0.23 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.541 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.46 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 9.2 t-160 -60.3 -55.89 28.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 117.083 0.441 . . . . 0.0 110.696 179.128 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.479 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 14.5 m-70 -51.83 -43.81 63.3 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.74 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.9 t80 -60.08 -27.99 67.44 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.993 -1.912 . . . . 0.0 110.067 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.528 ' O ' HG21 ' B' ' 43' ' ' VAL . 0.9 OUTLIER -73.11 -62.46 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.307 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.6 OUTLIER -48.27 -64.14 0.88 Allowed 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.704 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.476 ' HB2' HD22 ' A' ' 125' ' ' LEU . . . -47.16 -44.06 21.56 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.105 -0.638 . . . . 0.0 109.782 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -50.49 -45.22 56.27 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-O 121.451 0.643 . . . . 0.0 110.137 179.622 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.528 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -72.85 -60.62 2.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.129 179.055 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.418 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.6 mtt180 -34.66 -41.6 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 122.264 1.03 . . . . 0.0 109.123 177.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.716 HG21 ' HA ' ' A' ' 122' ' ' GLN . 70.6 t -72.44 -61.1 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.84 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 34.8 t . . . . . 0 N--CA 1.447 -0.611 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.679 -176.417 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 121.244 0.545 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -79.77 -49.89 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.792 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.475 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -53.84 -31.63 50.08 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.965 -179.11 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.607 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 65.0 m -81.53 -34.35 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.446 -0.501 . . . . 0.0 111.828 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . 0.624 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 48.0 t -56.18 -34.64 66.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 98.6 mt -81.6 -55.66 4.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.281 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' SER . . . . . 0.456 ' HG ' ' H ' ' A' ' 119' ' ' GLY . 16.0 p -104.7 -53.32 2.71 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.994 -179.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.607 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 118.62 162.87 12.31 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.913 -0.661 . . . . 0.0 111.926 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . 0.724 ' SG ' HD11 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -117.4 157.28 26.47 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.545 0.688 . . . . 0.0 111.878 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.578 ' C ' ' H ' ' A' ' 123' ' ' GLN . 58.3 p -93.69 159.64 15.12 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.526 178.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.727 ' HA ' HG23 ' B' ' 45' ' ' VAL . 26.3 mt-30 -65.37 6.1 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.578 ' H ' ' C ' ' A' ' 121' ' ' THR . 56.8 mt-30 -98.26 -53.65 3.29 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 175.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.524 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 3.4 m-20 -56.73 -53.98 51.54 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.653 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.2 mt -56.2 -32.54 64.47 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.901 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.483 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.3 mt -67.29 -37.59 83.66 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 123' ' ' GLN . 7.0 p -79.17 -5.9 55.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' A' ' 125' ' ' LEU . 71.0 mt . . . . . 0 N--CA 1.448 -0.558 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.565 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.9 tp10 . . . . . 0 CA--C 1.514 -0.42 0 CA-C-O 121.299 0.571 . . . . 0.0 110.604 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 70.2 mttt -63.75 110.4 2.04 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.739 -178.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.766 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 25.6 mt -107.82 108.36 19.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.403 -1.271 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' CYS . . . . . 0.624 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -102.1 77.84 1.72 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.396 0.617 . . . . 0.0 111.06 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 71.17 -79.9 0.5 Allowed Glycine 0 C--N 1.318 -0.47 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.994 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.487 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 6.1 t-160 -64.37 -51.95 60.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 117.43 0.615 . . . . 0.0 110.981 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' HIS . . . . . 0.471 ' HB3' HD22 ' B' ' 33' ' ' LEU . 10.8 m170 -54.58 -37.06 65.07 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.766 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.1 t80 -64.9 -27.99 69.23 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 113.095 -1.866 . . . . 0.0 109.736 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.53 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.7 t -73.63 -64.71 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.487 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.1 mpt_? -44.26 -59.88 2.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 123.37 0.419 . . . . 0.0 111.456 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.569 ' HB2' HD13 ' B' ' 33' ' ' LEU . . . -54.09 -46.18 71.99 Favored 'General case' 0 C--O 1.21 -0.974 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -47.87 -37.9 15.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.479 0.657 . . . . 0.0 110.076 -179.888 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' VAL . . . . . 0.53 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.6 OUTLIER -75.32 -60.45 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.071 178.902 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' ARG . . . . . 0.515 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.6 mtt180 -39.1 -37.54 0.39 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.333 1.063 . . . . 0.0 109.323 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.727 HG23 ' HA ' ' A' ' 122' ' ' GLN . 59.2 t -79.31 -70.78 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 113.223 -1.808 . . . . 0.0 113.894 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.0 t . . . . . 0 CA--C 1.518 -0.259 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.773 -176.271 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.822 0.344 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.43 170.28 9.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.946 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -129.35 -155.49 0.7 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.087 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.462 ' HG1' ' H ' ' A' ' 110' ' ' ASN . 13.2 t -74.98 -157.27 0.06 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.844 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.462 ' H ' ' HG1' ' A' ' 109' ' ' THR . 12.0 m120 -80.99 106.31 5.33 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.554 ' HB2' ' CZ ' ' B' ' 38' ' ' PHE . 24.5 Cg_endo -58.17 -37.68 94.46 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.23 1.953 . . . . 0.0 113.034 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.465 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -58.13 -42.65 86.26 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.164 0.507 . . . . 0.0 110.999 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -77.62 -48.77 16.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.855 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.465 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.91 -46.41 71.44 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.138 -179.468 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.514 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -74.55 -24.44 58.94 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.802 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.558 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.9 t -63.14 -40.55 97.9 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.787 0.327 . . . . 0.0 110.999 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.4 mt -80.9 -45.0 17.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.821 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 32.5 t -108.31 -53.89 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.41 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 126.03 167.86 12.54 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.621 -179.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 68.1 m -140.64 138.73 34.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.41 ' C ' ' N ' ' A' ' 123' ' ' GLN . 82.0 p -81.24 160.2 24.34 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.376 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.722 ' HA ' HG21 ' B' ' 45' ' ' VAL . 7.2 mt-30 -54.31 -17.64 3.18 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.415 ' O ' HG23 ' A' ' 127' ' ' THR . 44.9 mt-30 -71.27 -55.92 7.08 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.574 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -53.01 -56.01 19.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.866 -0.791 . . . . 0.0 108.866 178.435 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.472 ' HB3' ' HA ' ' B' ' 42' ' ' LEU . 1.2 mp -57.95 -32.18 67.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.028 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 7.0 mt -63.99 -28.3 69.71 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 120.837 0.351 . . . . 0.0 110.24 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -102.0 -2.6 29.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.722 -179.618 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 59.0 mt -96.1 -16.74 21.38 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.379 -179.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 30.2 p -71.42 155.52 92.65 Favored Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.376 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.51 25.5 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.259 2.64 . . . . 0.0 112.727 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.951 179.816 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.483 0.907 0 N-CA-C 111.009 -0.42 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 59.1 p 54.34 119.23 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.017 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -93.89 -157.33 0.05 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 122.976 2.45 . . . . 0.0 111.847 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.407 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 3.2 pt-20 -81.08 77.21 8.0 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.733 0.778 . . . . 0.0 109.989 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 23.4 ttt -82.19 14.94 2.6 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.714 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.406 ' HG3' ' CG2' ' A' ' 121' ' ' THR . 0.1 OUTLIER 40.65 37.69 0.52 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.767 179.828 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.451 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.6 pt-20 -66.0 157.14 31.64 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.499 0.666 . . . . 0.0 110.934 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -62.6 107.09 0.88 Allowed 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.676 -177.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.701 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 24.6 mt -97.59 95.74 7.82 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.692 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.558 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 33.9 m -92.31 85.96 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.576 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.88 -78.41 0.01 OUTLIER Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.776 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.476 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 5.9 t-160 -63.5 -54.18 40.41 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 117.074 0.437 . . . . 0.0 111.161 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.45 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 12.0 m-70 -52.37 -42.84 64.31 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 176.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.701 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 35.1 t80 -62.84 -28.81 70.28 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 112.579 -2.1 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.538 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.5 t -71.85 -66.9 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.415 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.9 OUTLIER -46.15 -59.12 3.08 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 119.374 -0.346 . . . . 0.0 110.641 178.844 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.535 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -51.3 -49.5 61.16 Favored 'General case' 0 C--O 1.213 -0.864 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.249 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.671 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.47 -38.62 4.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.381 0.61 . . . . 0.0 110.035 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.569 HG13 ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -78.05 -65.7 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.332 179.345 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 6.1 mtt180 -32.87 -42.42 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 122.473 1.13 . . . . 0.0 109.94 177.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.722 HG21 ' HA ' ' A' ' 122' ' ' GLN . 58.8 t -74.67 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.105 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.3 t -119.44 -55.36 2.13 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.631 -176.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.569 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 146.26 -90.97 0.15 Allowed Glycine 0 C--N 1.317 -0.499 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.392 -178.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.5 ' CA ' ' HE1' ' B' ' 51' ' ' TRP . . . 134.54 -138.56 10.14 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.134 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.589 ' HD2' ' NE1' ' B' ' 51' ' ' TRP . 56.8 Cg_endo -70.75 -67.11 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.663 2.242 . . . . 0.0 113.003 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.423 ' C ' ' H ' ' B' ' 52' ' ' SER . 82.5 mtm180 -157.44 -44.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.936 0.398 . . . . 0.0 111.49 -178.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.589 ' NE1' ' HD2' ' B' ' 49' ' ' PRO . 18.3 m95 63.01 -0.76 0.56 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.519 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' SER . . . . . 0.462 ' O ' ' N ' ' B' ' 54' ' ' GLU . 69.0 m -71.78 -74.98 0.14 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.752 0.311 . . . . 0.0 110.617 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 81.6 p 53.73 -77.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.212 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . 0.462 ' N ' ' O ' ' B' ' 52' ' ' SER . 34.8 tt0 -81.58 -11.67 59.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.124 0.488 . . . . 0.0 110.959 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . 0.401 ' HB2' ' HB3' ' B' ' 52' ' ' SER . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.009 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.811 0.339 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -155.1 -18.95 0.11 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.247 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -107.26 -165.49 1.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.215 0.531 . . . . 0.0 111.352 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 12.1 t -77.56 -159.67 0.15 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.811 178.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -82.76 105.38 4.87 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.494 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 30.5 Cg_endo -59.71 -4.21 2.53 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.43 2.087 . . . . 0.0 113.254 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.403 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -86.09 -54.37 4.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.248 0.547 . . . . 0.0 109.905 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.46 -24.3 56.95 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.491 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.494 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -62.89 -58.16 8.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.184 179.185 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.597 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -71.85 -29.61 64.57 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.437 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.626 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -57.45 -34.86 69.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.006 0.431 . . . . 0.0 110.479 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.9 mt -79.58 -59.67 2.65 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.891 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.3 m -105.14 -39.45 6.2 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 113.0 157.59 12.87 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.418 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 73.1 m -127.69 148.12 50.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.26 0.553 . . . . 0.0 112.424 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.448 ' OG1' ' HB2' ' A' ' 123' ' ' GLN . 12.5 p -84.76 165.7 17.59 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.334 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.75 ' HA ' HG21 ' B' ' 45' ' ' VAL . 11.1 mt-30 -65.27 0.09 1.56 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.408 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.448 ' HB2' ' OG1' ' A' ' 121' ' ' THR . 23.4 mt-30 -92.06 -53.49 4.23 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.207 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.572 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.64 -54.22 46.83 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.374 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.547 ' HB2' HG13 ' B' ' 45' ' ' VAL . 1.1 mt -57.47 -33.19 67.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.487 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 5.5 mt -62.85 -28.31 69.94 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.996 0.427 . . . . 0.0 110.205 178.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -98.07 -4.29 36.23 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.382 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 50.8 mt -93.97 -18.18 22.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.626 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 29.4 p -69.38 154.93 94.43 Favored Pre-proline 0 CA--C 1.53 0.191 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.399 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -85.25 -1.18 9.2 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.139 2.559 . . . . 0.0 112.511 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.974 179.977 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.484 0.917 0 N-CA-C 111.157 -0.363 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 32.9 p -74.12 140.57 76.92 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.052 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 69.5 Cg_endo -94.01 69.7 0.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.034 2.489 . . . . 0.0 112.031 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 35.85 65.32 0.43 Allowed 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.78 0.8 . . . . 0.0 111.515 -178.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 5.6 ttp -77.93 111.65 14.01 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.527 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.409 ' HG2' HG21 ' A' ' 121' ' ' THR . 2.7 mtt180 -78.35 123.93 27.54 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.832 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.741 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.2 pt-20 -142.03 142.18 32.87 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.195 179.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -60.06 112.03 1.73 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.961 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.744 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.8 mt -106.14 99.05 8.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.528 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.626 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -100.23 96.73 7.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.137 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.49 -83.16 0.01 OUTLIER Glycine 0 C--N 1.321 -0.285 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.966 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.446 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 4.4 t-160 -64.43 -54.14 37.25 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.241 0.52 . . . . 0.0 111.475 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.43 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.5 m-70 -53.59 -39.06 64.55 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.744 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.5 t80 -65.47 -27.94 68.86 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 112.916 -1.947 . . . . 0.0 109.77 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.529 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.6 t -74.22 -68.01 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.388 -0.824 . . . . 0.0 108.847 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.402 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.4 OUTLIER -43.79 -57.83 3.04 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 123.25 0.344 . . . . 0.0 111.086 179.379 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.471 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -52.78 -51.82 59.13 Favored 'General case' 0 C--O 1.212 -0.893 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.301 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.625 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.33 -39.64 3.21 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.279 0.561 . . . . 0.0 110.476 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.672 HG13 ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -76.22 -64.57 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.073 179.29 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -34.45 -41.84 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.523 1.154 . . . . 0.0 110.051 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.75 HG21 ' HA ' ' A' ' 122' ' ' GLN . 68.3 t -73.78 -65.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 112.768 -2.014 . . . . 0.0 113.38 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 11.2 t -111.66 -42.24 3.88 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.603 -176.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.672 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 108.36 10.39 25.68 Favored Glycine 0 C--N 1.317 -0.483 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.932 -178.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' B' ' 47' ' ' GLY . . . 29.41 -134.01 0.07 OUTLIER Glycine 0 C--N 1.336 0.572 0 O-C-N 124.031 0.489 . . . . 0.0 113.298 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.512 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 59.1 Cg_endo -68.67 -135.09 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 122.709 2.273 . . . . 0.0 112.473 179.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.462 ' H ' ' HB2' ' B' ' 49' ' ' PRO . 87.3 mtt180 -81.61 -55.64 4.53 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.524 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 38.5 m95 67.2 10.57 7.81 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.194 -177.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 74.2 m 60.45 175.67 0.1 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.971 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 23.3 p -154.65 -47.52 0.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.176 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -157.04 72.92 0.73 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.997 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.292 -0.861 . . . . 0.0 111.057 -179.924 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.853 0.359 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -155.38 21.78 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.207 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.15 -161.89 0.84 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.078 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 14.1 t -75.66 -149.4 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.936 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -80.67 107.85 8.41 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.486 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 56.5 Cg_endo -66.07 -7.04 15.89 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.266 1.977 . . . . 0.0 112.297 -179.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.01 -42.25 9.54 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.998 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 25.5 ttt180 -77.86 -51.6 10.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.183 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.49 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -51.91 -35.94 47.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.649 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 74.3 m -79.0 -30.67 44.4 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 112.04 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.64 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.5 t -56.89 -45.46 82.57 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.574 -0.451 . . . . 0.0 110.006 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 19.5 mt -81.03 -38.94 26.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.316 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.5 t -106.66 -72.7 0.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.649 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.36 156.79 8.97 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.729 ' SG ' HD11 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -113.24 159.68 19.08 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.709 0.766 . . . . 0.0 112.233 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.478 ' C ' ' H ' ' A' ' 123' ' ' GLN . 64.0 p -95.78 155.29 16.81 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.293 178.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.656 ' HA ' HG21 ' B' ' 45' ' ' VAL . 20.5 mt-30 -60.25 -3.28 0.59 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.496 ' O ' HG23 ' A' ' 127' ' ' THR . 47.6 mt-30 -87.86 -56.37 3.37 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.574 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.8 t70 -53.1 -54.33 37.15 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.613 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.2 mt -56.94 -35.01 68.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.321 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.459 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.0 mt -64.07 -25.54 68.15 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-O 120.822 0.344 . . . . 0.0 110.162 178.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.2 p -97.14 -6.76 34.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.483 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 29.0 mt -91.78 -21.85 20.47 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.886 0.374 . . . . 0.0 110.536 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.459 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 31.2 p -69.75 154.27 94.88 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.501 178.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.414 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 2.4 Cg_endo -82.0 6.13 5.89 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 123.188 2.592 . . . . 0.0 112.244 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.899 -179.908 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo . . . . . 0 N--CA 1.484 0.918 0 N-CA-C 111.094 -0.387 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 65.7 p -74.22 127.28 88.1 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.987 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -98.03 -159.18 0.05 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.189 2.593 . . . . 0.0 111.62 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -83.24 71.92 10.19 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.801 0.81 . . . . 0.0 110.016 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.2 tmm? -79.35 104.92 10.3 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.565 -179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.439 ' CG ' HG21 ' A' ' 121' ' ' THR . 8.4 mtt180 -79.53 162.86 25.12 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.77 -179.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.605 ' HG3' HD21 ' B' ' 33' ' ' LEU . 11.8 pt-20 -166.75 137.22 3.2 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.628 0.728 . . . . 0.0 110.696 179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.99 112.4 2.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.183 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.768 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 31.4 mt -112.74 107.29 15.88 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.695 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -101.84 81.12 2.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.53 0.681 . . . . 0.0 111.206 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.425 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 65.09 -81.97 0.07 OUTLIER Glycine 0 C--N 1.321 -0.294 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.932 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -58.0 -56.08 26.61 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 117.315 0.558 . . . . 0.0 110.871 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -52.59 -46.53 66.97 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.768 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 24.7 t80 -54.26 -31.01 52.53 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.187 -1.824 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.603 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.2 t -72.83 -52.49 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.438 ' NE ' HG11 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -51.53 -65.04 0.63 Allowed 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.61 0.569 . . . . 0.0 110.912 179.421 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.516 ' HB2' HD13 ' B' ' 33' ' ' LEU . . . -50.32 -45.88 55.09 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.653 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -47.05 -40.89 15.82 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.255 0.55 . . . . 0.0 109.813 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.603 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.6 OUTLIER -73.48 -65.13 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.029 178.342 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.425 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.8 mtt180 -34.0 -41.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.086 177.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.656 HG21 ' HA ' ' A' ' 122' ' ' GLN . 78.5 t -74.5 -60.37 2.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 113.417 -1.72 . . . . 0.0 112.447 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 10.2 t -124.15 -57.71 1.58 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.68 -176.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.573 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 150.55 -95.85 0.16 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.966 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.414 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . 140.19 -135.79 7.32 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.165 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.569 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 57.9 Cg_endo -70.14 -68.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.72 2.28 . . . . 0.0 112.339 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.476 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 0.1 OUTLIER -158.62 -42.43 0.06 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.697 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.569 ' CE2' ' HD2' ' B' ' 49' ' ' PRO . 14.1 m95 64.1 -1.4 0.7 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.184 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' SER . . . . . 0.416 ' H ' ' C ' ' B' ' 50' ' ' ARG . 4.3 m -115.87 112.76 22.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.738 0.304 . . . . 0.0 110.783 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 12.3 p -156.59 -45.8 0.07 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.015 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -150.8 -176.33 5.48 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.562 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.105 179.988 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.785 0.326 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -83.53 132.08 34.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.973 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.53 -159.28 0.7 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.166 0.507 . . . . 0.0 111.409 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.42 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 12.7 t -75.29 -157.76 0.07 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.087 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -82.35 105.08 4.08 Favored Pre-proline 0 C--N 1.327 -0.405 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.509 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 56.9 Cg_endo -65.42 2.25 1.63 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.351 2.034 . . . . 0.0 113.335 -178.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.455 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -89.66 -52.36 5.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.367 0.604 . . . . 0.0 109.713 178.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -77.18 -24.95 51.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.194 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.509 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -63.83 -54.91 27.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.473 179.382 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.546 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.7 m -74.82 -14.13 60.65 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.586 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.603 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.0 t -76.91 -28.16 55.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.032 0.444 . . . . 0.0 110.075 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.0 mt -81.11 -34.44 32.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.699 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.422 ' HB3' ' NH1' ' B' ' 30' ' ' ARG . 3.1 m -138.33 -36.09 0.59 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.406 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 118.36 171.74 15.34 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.763 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.483 ' HB2' HD11 ' B' ' 33' ' ' LEU . 71.2 m -140.58 138.38 34.41 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.287 0.565 . . . . 0.0 112.463 -179.379 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.495 ' HB ' ' HB2' ' B' ' 28' ' ' GLU . 74.2 p -77.25 157.88 30.58 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.501 179.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.7 ' HA ' HG21 ' B' ' 45' ' ' VAL . 15.8 mt-30 -53.57 -20.63 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.41 ' O ' HG23 ' A' ' 127' ' ' THR . 21.7 mt-30 -70.53 -54.02 13.82 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.572 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -53.94 -53.03 58.45 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 178.258 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.456 HD22 ' N ' ' B' ' 42' ' ' LEU . 1.1 mt -61.12 -30.72 70.54 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.629 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 7.0 mt -63.44 -27.17 69.1 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.41 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.5 OUTLIER -92.38 -16.0 26.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.902 179.759 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 14.5 mt -96.62 -1.43 46.85 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 121.561 0.696 . . . . 0.0 109.267 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.564 ' N ' ' CD ' ' A' ' 130' ' ' PRO . 36.7 t -56.73 -44.24 99.68 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 114.647 -1.16 . . . . 0.0 112.503 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 129' ' ' CYS . 60.1 Cg_endo -86.65 6.68 5.27 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.712 2.941 . . . . 0.0 112.325 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.926 179.857 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo . . . . . 0 N--CA 1.484 0.96 0 N-CA-C 111.168 -0.358 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -73.53 120.18 79.79 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.02 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -96.8 -157.41 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.124 2.549 . . . . 0.0 111.829 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.495 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 3.3 pt-20 -80.97 78.64 7.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.639 0.733 . . . . 0.0 110.046 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 46.7 ttm -83.47 10.91 7.78 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.191 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.422 ' NH1' ' HB3' ' A' ' 118' ' ' SER . 0.2 OUTLIER 37.67 34.78 0.06 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.405 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.552 ' HG3' HD21 ' B' ' 33' ' ' LEU . 11.8 pt-20 -66.06 155.83 35.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.42 0.628 . . . . 0.0 110.858 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.403 ' HA ' ' CA ' ' A' ' 119' ' ' GLY . 13.9 mtpt -63.16 108.2 1.21 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.625 -178.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.756 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 9.7 mt -101.91 98.86 9.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.959 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.603 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.7 t -99.83 94.09 6.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.251 0.548 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.11 -83.4 0.02 OUTLIER Glycine 0 C--N 1.321 -0.264 0 CA-C-N 115.029 -0.987 . . . . 0.0 112.991 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -60.19 -57.3 13.38 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.91 0.355 . . . . 0.0 111.493 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 8.2 m170 -52.96 -44.73 67.35 Favored 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.756 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 20.2 t80 -57.7 -28.99 64.32 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.897 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.529 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.0 OUTLIER -74.15 -60.22 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.145 177.815 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.462 ' HG3' HH11 ' B' ' 40' ' ' ARG . 0.5 OUTLIER -49.43 -64.34 0.84 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 119.414 -0.327 . . . . 0.0 110.632 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.525 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -46.05 -49.23 16.55 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.498 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.615 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.56 -41.0 6.16 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.322 0.582 . . . . 0.0 110.431 179.883 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.659 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -79.84 -59.74 2.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.489 179.595 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -36.22 -39.37 0.18 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.104 0.954 . . . . 0.0 109.335 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.7 HG21 ' HA ' ' A' ' 122' ' ' GLN . 59.8 t -76.02 -53.17 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 113.538 -1.664 . . . . 0.0 111.387 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 45.6 t -147.38 -63.98 0.27 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.271 -177.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.659 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 143.75 124.91 1.86 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.035 -0.984 . . . . 0.0 112.123 -177.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.657 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . -66.81 -119.31 0.02 OUTLIER Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.27 -0.491 . . . . 0.0 113.511 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.549 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 63.9 Cg_endo -70.72 -72.05 0.02 OUTLIER 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.555 2.836 . . . . 0.0 114.294 -178.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.5 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 35.3 mmt180 -152.39 -38.25 0.11 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.715 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.657 ' HE1' ' N ' ' B' ' 48' ' ' GLY . 7.8 m95 62.12 9.21 3.01 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.09 178.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 37.5 m -138.27 142.07 39.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.752 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 23.5 p -154.73 -59.43 0.11 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.917 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -82.48 13.16 3.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.344 -0.836 . . . . 0.0 111.117 179.949 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.828 0.347 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.09 -77.68 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.213 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -131.55 -161.28 1.12 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.246 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 9.2 t -76.36 -137.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.417 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -81.77 109.42 14.81 Favored Pre-proline 0 C--N 1.331 -0.224 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.488 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 64.6 Cg_endo -71.32 88.61 0.72 Allowed 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.031 1.82 . . . . 0.0 111.631 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.488 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 164.85 -57.15 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.139 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.07 -34.34 59.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.335 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.437 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -62.19 -29.26 70.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.334 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.635 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 60.3 m -84.01 -33.91 24.42 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.813 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.6 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.6 t -54.9 -35.5 64.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 44.2 mt -82.4 -53.72 5.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.453 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 58.3 m -106.91 -58.46 1.93 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.635 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 128.64 174.22 13.67 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.372 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.591 ' SG ' HD13 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -133.13 155.17 49.77 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.376 0.588 . . . . 0.0 111.701 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.57 ' CG2' ' HG2' ' B' ' 30' ' ' ARG . 67.8 p -97.71 159.94 14.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.524 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.723 ' HA ' HG23 ' B' ' 45' ' ' VAL . 16.3 mt-30 -62.13 2.67 0.22 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.538 ' H ' ' C ' ' A' ' 121' ' ' THR . 19.9 mt-30 -94.92 -57.01 2.56 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 2.7 m-20 -55.41 -51.0 68.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.581 ' HB2' HG13 ' B' ' 45' ' ' VAL . 1.2 mt -59.04 -34.73 72.25 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.097 179.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.464 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.4 mt -63.24 -30.35 71.51 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.745 0.307 . . . . 0.0 110.796 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -94.43 -5.46 46.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.519 -179.613 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 95.5 mt -95.82 -20.57 18.72 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.799 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.432 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 24.7 p -58.42 148.42 64.67 Favored Pre-proline 0 C--N 1.332 -0.157 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.678 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.512 ' HG2' ' HB3' ' B' ' 49' ' ' PRO . 2.7 Cg_exo -76.46 -7.0 17.58 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.06 2.507 . . . . 0.0 112.553 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.935 179.951 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo . . . . . 0 N--CA 1.483 0.899 0 N-CA-C 111.225 -0.337 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 4.7 t -166.05 141.94 4.09 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.031 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 90.6 Cg_endo -97.8 -158.56 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.196 2.597 . . . . 0.0 112.293 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.455 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 2.8 pt-20 -81.95 77.77 8.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.606 0.717 . . . . 0.0 110.478 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 20.7 ttt -86.61 19.81 2.74 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.617 -1.174 . . . . 0.0 111.816 -179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.57 ' HG2' ' CG2' ' A' ' 121' ' ' THR . 0.0 OUTLIER 40.1 35.05 0.23 Allowed 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.07 179.377 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.608 ' HG3' HD21 ' B' ' 33' ' ' LEU . 11.9 pt-20 -64.97 152.45 43.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.526 0.679 . . . . 0.0 111.892 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 118' ' ' SER . 81.6 mttt -65.64 109.59 2.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.204 -1.362 . . . . 0.0 112.799 -177.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.747 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 58.7 mt -105.78 96.61 6.61 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.537 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.6 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.8 t -92.23 84.44 5.22 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.351 -179.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 63.11 -77.79 0.03 OUTLIER Glycine 0 C--N 1.32 -0.35 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.976 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.459 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 3.9 t-160 -65.1 -52.46 55.3 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.32 0.56 . . . . 0.0 111.054 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.544 ' HB3' HD22 ' B' ' 33' ' ' LEU . 11.6 m170 -55.23 -35.32 64.81 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.747 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 47.0 t80 -69.5 -26.42 64.53 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 113.007 -1.906 . . . . 0.0 109.664 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.497 ' O ' HG21 ' B' ' 43' ' ' VAL . 2.3 t -73.71 -68.33 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 176.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.459 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 2.4 mpt_? -43.76 -55.11 4.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.525 0.516 . . . . 0.0 110.942 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.484 ' O ' ' CG2' ' B' ' 45' ' ' VAL . . . -56.12 -49.35 74.15 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.084 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.678 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -45.45 -40.88 8.8 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.469 0.652 . . . . 0.0 110.104 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.688 HG12 ' NE1' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -71.18 -62.02 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.907 178.903 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.473 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.9 mtt180 -38.68 -38.33 0.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.337 1.065 . . . . 0.0 109.759 177.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.723 HG23 ' HA ' ' A' ' 122' ' ' GLN . 58.5 t -76.18 -63.38 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 113.072 -1.877 . . . . 0.0 114.024 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.432 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 7.8 t -112.9 -35.29 5.49 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.54 -176.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.629 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 105.05 18.21 12.68 Favored Glycine 0 C--N 1.318 -0.421 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.757 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 40.87 -152.83 0.09 OUTLIER Glycine 0 CA--C 1.521 0.431 0 N-CA-C 114.015 0.366 . . . . 0.0 114.015 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.517 ' C ' ' H ' ' B' ' 51' ' ' TRP . 57.5 Cg_endo -84.67 47.72 2.22 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.072 2.515 . . . . 0.0 113.046 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 67.37 -23.63 0.11 Allowed 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.688 ' NE1' HG12 ' B' ' 43' ' ' VAL . 16.5 m95 56.91 15.22 2.19 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 51.1 m -52.57 165.77 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.053 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 32.8 p -154.16 -41.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.058 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -82.25 -167.71 1.68 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.381 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.068 -179.886 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.871 0.367 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -160.64 133.58 6.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.023 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.13 -164.84 1.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.201 0.525 . . . . 0.0 111.399 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.462 ' HG1' ' H ' ' A' ' 110' ' ' ASN . 13.5 t -76.77 -156.71 0.08 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.044 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.462 ' H ' ' HG1' ' A' ' 109' ' ' THR . 2.3 m-20 -83.0 103.88 3.04 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.535 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 43.2 Cg_endo -63.11 -1.65 3.09 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.396 2.064 . . . . 0.0 113.357 -178.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.455 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -85.87 -52.91 5.43 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.403 0.62 . . . . 0.0 109.617 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.65 -26.0 50.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.474 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.535 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -63.16 -56.24 18.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.571 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.596 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -72.98 -29.17 62.85 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.791 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.628 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.5 t -57.44 -37.58 73.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.729 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 14.3 mt -79.58 -56.44 4.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.833 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.9 m -105.27 -43.16 5.07 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 115.01 160.67 12.92 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.386 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 73.9 m -131.21 148.17 52.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.307 0.575 . . . . 0.0 112.534 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.508 ' HG1' ' HB2' ' A' ' 123' ' ' GLN . 12.3 p -85.44 164.47 17.86 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.038 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.71 ' HA ' HG21 ' B' ' 45' ' ' VAL . 40.8 mt-30 -63.11 -3.68 1.9 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.213 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.508 ' HB2' ' HG1' ' A' ' 121' ' ' THR . 11.8 mm-40 -87.87 -54.28 4.32 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.582 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.49 -54.07 48.47 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.389 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.557 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.1 mt -57.46 -32.8 67.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.533 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.466 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.8 mt -64.13 -27.99 69.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.852 0.358 . . . . 0.0 110.11 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.414 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -94.9 -7.35 40.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.232 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 34.5 mt -93.14 -17.97 23.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.759 0.314 . . . . 0.0 110.521 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 19.4 p -73.61 161.51 78.54 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.392 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.8 18.31 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.928 2.419 . . . . 0.0 112.479 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.149 -0.929 . . . . 0.0 110.887 179.864 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . 0.408 ' H2 ' ' H ' ' B' ' 26' ' ' THR . 3.8 Cg_exo . . . . . 0 N--CA 1.484 0.956 0 N-CA-C 111.244 -0.329 . . . . 0.0 111.244 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.408 ' H ' ' H2 ' ' B' ' 25' ' ' PRO . 9.7 p 62.85 141.41 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.256 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.549 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 89.0 Cg_endo -93.51 -157.73 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.056 2.504 . . . . 0.0 111.835 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.57 64.26 6.21 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-O 121.787 0.804 . . . . 0.0 110.625 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 2.3 mtp -79.36 106.28 11.28 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.937 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.433 ' HG2' HG21 ' A' ' 121' ' ' THR . 3.5 mtt180 -78.19 122.01 25.1 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.781 -179.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.74 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.1 pt-20 -138.37 144.66 40.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.201 179.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -62.73 112.58 2.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.923 -177.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.754 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 4.8 mt -106.42 99.68 9.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.421 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.628 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -99.98 98.74 9.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.395 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 56.66 -83.27 0.01 OUTLIER Glycine 0 C--N 1.322 -0.242 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.057 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.426 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.3 t-160 -63.4 -55.14 26.78 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 117.281 0.541 . . . . 0.0 111.439 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -53.06 -42.84 66.21 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.754 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 19.7 t80 -60.09 -30.58 69.34 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.001 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.658 HG11 ' HE ' ' B' ' 40' ' ' ARG . 1.4 t -72.76 -64.2 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.658 ' HE ' HG11 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -42.71 -62.63 0.95 Allowed 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 123.617 0.573 . . . . 0.0 110.634 179.065 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.495 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -51.0 -52.72 40.0 Favored 'General case' 0 C--O 1.21 -0.975 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.233 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.62 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.79 -38.81 3.43 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.042 0.448 . . . . 0.0 110.439 -179.88 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.587 HG21 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -76.98 -64.4 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.055 179.058 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 -33.83 -43.56 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.468 1.128 . . . . 0.0 110.136 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.71 HG21 ' HA ' ' A' ' 122' ' ' GLN . 57.3 t -72.47 -58.86 4.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 112.799 -2.001 . . . . 0.0 112.676 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.5 t -127.54 -59.42 1.22 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.508 -176.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.587 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 154.96 -106.9 0.3 Allowed Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.679 -178.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 150.62 -144.56 11.99 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.437 -0.887 . . . . 0.0 112.447 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.529 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 95.9 Cg_endo -80.06 38.13 0.72 Allowed 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.702 2.268 . . . . 0.0 112.225 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 72.15 -27.06 0.18 Allowed 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.891 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.587 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 12.4 m95 62.61 129.21 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 121.942 0.877 . . . . 0.0 112.575 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 68.3 m 62.01 148.84 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.022 -1.444 . . . . 0.0 111.506 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -158.96 -56.61 0.07 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.096 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 45.06 46.91 9.61 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.329 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.128 -179.897 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.853 0.358 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -160.69 23.89 0.15 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -128.89 -161.0 1.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.162 0.506 . . . . 0.0 111.298 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.5 t -76.97 -159.86 0.14 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.874 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -82.68 104.9 3.99 Favored Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.583 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 33.9 Cg_endo -59.62 -21.31 61.97 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.296 1.997 . . . . 0.0 113.178 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.466 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -67.52 -53.96 24.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.237 0.541 . . . . 0.0 110.417 179.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -21.35 52.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.566 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.583 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -71.02 -51.29 26.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.983 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.56 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.4 m -74.56 -19.09 60.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.113 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.632 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.3 t -71.12 -48.58 51.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.786 0.326 . . . . 0.0 111.164 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.1 mt -80.85 -15.08 57.3 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 47.8 t -134.44 -52.73 0.82 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.407 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 115.69 147.78 9.12 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.448 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.533 ' HA ' ' NH1' ' B' ' 30' ' ' ARG . 95.4 m -122.67 140.7 52.56 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.513 HG21 ' CG ' ' B' ' 30' ' ' ARG . 75.3 p -76.72 155.51 33.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.756 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.684 ' HA ' HG21 ' B' ' 45' ' ' VAL . 20.2 mt-30 -55.15 -20.25 9.75 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.447 ' O ' ' HB2' ' A' ' 126' ' ' LEU . 6.9 mp0 -69.84 -51.83 30.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.6 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -54.63 -57.11 12.72 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.019 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.489 ' HB3' ' HA ' ' B' ' 42' ' ' LEU . 1.1 mt -56.21 -30.75 62.75 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.64 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.2 mt -62.88 -31.71 72.81 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.069 0.461 . . . . 0.0 109.847 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.54 -1.44 35.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.707 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 72.7 mt -93.31 -19.32 21.47 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.129 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.455 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 17.2 p -73.28 162.26 75.26 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.253 178.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.467 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 6.8 Cg_exo -74.46 -72.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.725 2.283 . . . . 0.0 112.212 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 . . . . . 0 C--O 1.249 1.046 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.907 179.992 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo . . . . . 0 N--CA 1.483 0.901 0 N-CA-C 111.145 -0.367 . . . . 0.0 111.145 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 3.2 p -160.9 143.1 9.29 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.727 -179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -89.01 -158.73 0.08 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.647 2.232 . . . . 0.0 111.887 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.411 ' HB3' ' OE1' ' A' ' 123' ' ' GLN . 5.8 pt-20 -82.2 64.38 6.83 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.861 0.838 . . . . 0.0 110.645 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 22.9 ttt -83.77 12.28 6.22 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.864 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.533 ' NH1' ' HA ' ' A' ' 120' ' ' CYS . 1.3 mtt-85 51.3 173.53 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.12 -0.946 . . . . 0.0 112.678 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.55 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.3 tp10 173.89 139.4 0.04 OUTLIER 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.978 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 60.4 mttt -68.14 101.99 1.26 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.431 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.734 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.5 mt -99.91 98.44 9.22 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.42 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.632 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.9 t -98.71 94.57 6.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.167 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.49 -80.6 0.01 OUTLIER Glycine 0 C--N 1.32 -0.357 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.901 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.482 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 3.5 t-160 -65.98 -55.24 17.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.184 0.492 . . . . 0.0 111.494 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.439 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -53.14 -36.85 61.28 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 177.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.734 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.9 t80 -67.72 -29.22 68.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 112.988 -1.914 . . . . 0.0 109.822 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.53 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.5 t -73.11 -65.61 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.387 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.9 OUTLIER -48.34 -58.6 4.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 119.204 -0.426 . . . . 0.0 110.934 179.221 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.44 ' O ' ' CG2' ' B' ' 45' ' ' VAL . . . -50.53 -47.07 57.69 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.519 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.616 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.17 -39.24 13.35 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.205 0.526 . . . . 0.0 110.275 179.582 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.724 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -79.76 -62.48 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.382 179.697 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mtt180 -32.25 -40.8 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.437 1.113 . . . . 0.0 108.866 176.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.684 HG21 ' HA ' ' A' ' 122' ' ' GLN . 91.2 t -74.93 -66.43 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 112.949 -1.932 . . . . 0.0 112.215 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 47.7 t -127.79 -62.08 1.09 Allowed 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.057 -175.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.724 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 126.41 112.16 1.79 Allowed Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.611 -178.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.467 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . -62.25 -117.65 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 121.057 -0.592 . . . . 0.0 111.998 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.618 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 55.8 Cg_endo -68.74 -137.9 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.768 2.312 . . . . 0.0 111.516 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.464 ' C ' ' H ' ' B' ' 52' ' ' SER . 22.5 mmm180 -85.26 -40.09 17.0 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.618 ' CZ2' ' HD2' ' B' ' 49' ' ' PRO . 37.2 m95 70.74 -21.76 0.19 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -179.254 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' SER . . . . . 0.464 ' H ' ' C ' ' B' ' 50' ' ' ARG . 11.4 m -140.17 118.5 12.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.872 0.368 . . . . 0.0 110.968 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.92 -70.51 0.07 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.081 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -83.49 5.83 22.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.298 -179.839 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.799 0.333 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.41 154.93 24.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.016 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -135.59 -155.27 0.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.228 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 14.8 t -75.53 -143.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.264 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -78.46 113.28 32.96 Favored Pre-proline 0 C--N 1.33 -0.255 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.547 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 62.1 Cg_endo -69.07 -8.68 24.26 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.276 1.984 . . . . 0.0 112.923 -178.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.24 -39.28 10.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.292 0.568 . . . . 0.0 110.966 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -77.49 -52.3 9.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.334 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.547 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -54.8 -31.59 59.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.732 -178.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.642 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 68.1 m -79.92 -22.18 43.03 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.956 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.622 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.8 t -70.6 -33.94 71.6 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.4 mt -84.12 -24.72 30.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.155 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.464 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 78.1 p -136.58 -63.04 0.64 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.753 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.642 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.21 156.11 8.76 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.761 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.644 ' HB2' HD11 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -107.96 155.85 19.87 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 121.666 0.746 . . . . 0.0 112.213 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.505 ' HB ' ' HB2' ' B' ' 28' ' ' GLU . 32.7 p -94.84 151.27 19.37 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.441 178.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.621 ' HA ' HG21 ' B' ' 45' ' ' VAL . 9.9 mt-30 -56.56 -8.07 0.5 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.465 ' H ' ' C ' ' A' ' 121' ' ' THR . 3.9 mm100 -83.46 -54.96 4.58 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.537 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 1.7 t70 -54.27 -54.71 36.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.644 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.1 mt -56.67 -34.01 66.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.431 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.9 mt -62.89 -29.57 70.87 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.919 0.39 . . . . 0.0 110.572 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.75 -2.08 36.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.386 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 72.0 mt -92.96 -23.33 18.75 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.727 0.299 . . . . 0.0 110.694 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.463 ' HA ' ' HD3' ' A' ' 130' ' ' PRO . 25.2 p -62.72 146.07 94.94 Favored Pre-proline 0 C--O 1.232 0.137 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.419 178.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 129' ' ' CYS . 1.2 Cg_endo -84.69 -76.32 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.456 2.771 . . . . 0.0 112.537 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.34 -0.838 . . . . 0.0 110.919 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.483 0.909 0 N-CA-C 111.168 -0.358 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.42 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 1.1 p -161.78 133.64 4.09 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.917 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 91.4 Cg_endo -96.45 -156.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.251 2.634 . . . . 0.0 112.08 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.505 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 3.3 pt-20 -80.14 78.76 6.77 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.595 0.712 . . . . 0.0 110.251 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.429 ' O ' ' HG3' ' B' ' 29' ' ' MET . 6.0 tpt -84.95 9.97 13.04 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.684 -1.143 . . . . 0.0 111.494 -179.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.408 ' NH1' ' HB2' ' A' ' 118' ' ' SER . 0.0 OUTLIER 37.54 91.59 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.227 178.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 4.7 tp10 -110.06 150.28 28.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.234 0.54 . . . . 0.0 111.265 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 118' ' ' SER . 4.0 mtpm? -63.24 100.02 0.21 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.62 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.762 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 63.4 mt -100.24 102.25 13.48 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.826 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.622 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.1 t -98.14 76.86 2.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.361 0.6 . . . . 0.0 111.223 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.27 -75.61 0.5 Allowed Glycine 0 C--N 1.319 -0.373 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.857 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.436 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 5.2 t-160 -66.63 -53.17 37.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.496 0.648 . . . . 0.0 110.841 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.485 ' HB3' HD22 ' B' ' 33' ' ' LEU . 10.5 m170 -53.7 -38.17 63.99 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.762 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 37.8 t80 -64.75 -30.25 71.26 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.037 -1.892 . . . . 0.0 109.835 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.534 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.5 t -71.09 -66.32 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.423 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.2 mpt_? -46.26 -61.35 1.82 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 119.38 -0.343 . . . . 0.0 110.408 178.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.535 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -48.35 -50.14 31.61 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.513 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.664 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -45.16 -41.56 8.21 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.3 0.571 . . . . 0.0 110.067 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.661 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -74.81 -64.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.191 179.165 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 5.5 mtt180 -33.28 -41.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 122.289 1.042 . . . . 0.0 109.86 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.621 HG21 ' HA ' ' A' ' 122' ' ' GLN . 59.3 t -74.05 -58.54 4.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 113.277 -1.783 . . . . 0.0 112.561 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 22.2 t -129.89 -60.21 1.04 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.277 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.661 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 126.57 116.25 2.03 Favored Glycine 0 C--N 1.321 -0.303 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.445 -177.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.651 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . -61.87 -125.25 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.36 -0.447 . . . . 0.0 113.736 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.505 ' HG2' ' H ' ' B' ' 50' ' ' ARG . 60.5 Cg_endo -69.38 -69.24 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 123.116 2.544 . . . . 0.0 113.004 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.505 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 0.2 OUTLIER -156.56 -39.93 0.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.931 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.651 ' HE1' ' N ' ' B' ' 48' ' ' GLY . 11.2 m95 69.52 -67.32 0.23 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.208 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 63.8 m -158.65 -11.79 0.07 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.924 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 70.1 p -80.43 -47.42 14.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.277 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 46.54 69.42 0.49 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.256 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.082 -179.925 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.875 0.369 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -149.26 -178.17 6.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.944 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 59.36 -175.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.513 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -163.25 -53.19 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.241 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -158.21 82.73 2.78 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.195 178.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.455 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 17.8 Cg_endo -53.62 90.9 0.03 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.334 2.023 . . . . 0.0 111.762 -178.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 156.47 -62.09 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 113.998 -1.455 . . . . 0.0 107.434 -178.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.84 -18.8 53.43 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.951 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.438 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -72.55 -56.25 5.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.857 -179.585 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.582 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -74.35 -21.73 59.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.904 0.383 . . . . 0.0 110.923 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.646 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.7 t -68.99 -47.85 64.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.9 0.381 . . . . 0.0 110.903 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.2 mt -81.8 -17.5 47.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.287 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 t -132.21 -54.79 0.97 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.471 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 116.95 149.21 9.02 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.509 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.503 ' HA ' HH11 ' B' ' 30' ' ' ARG . 78.0 m -127.22 146.28 50.47 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.506 ' H ' HH11 ' B' ' 30' ' ' ARG . 65.9 p -87.23 165.06 15.97 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.833 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.791 ' HA ' HG21 ' B' ' 45' ' ' VAL . 14.3 mt-30 -61.68 -0.59 0.46 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 177.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.505 ' H ' ' C ' ' A' ' 121' ' ' THR . 79.7 mt-30 -89.85 -54.37 4.08 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 176.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.509 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -57.99 -50.12 74.5 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.473 ' HB2' HG13 ' B' ' 45' ' ' VAL . 1.1 mp -60.48 -31.72 70.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.24 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.438 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.2 mt -64.55 -28.43 69.64 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 120.961 0.41 . . . . 0.0 110.007 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.58 -5.57 42.3 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.501 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 44.5 mt -96.44 -18.62 19.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.175 -179.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.45 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 32.0 p -67.91 150.66 97.68 Favored Pre-proline 0 C--N 1.331 -0.206 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.527 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -85.69 -7.51 8.53 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.283 2.655 . . . . 0.0 112.36 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.892 -179.916 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 N--CA 1.484 0.937 0 N-CA-C 111.067 -0.397 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.9 t -166.49 144.24 4.38 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.385 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -93.03 -156.08 0.05 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.202 2.602 . . . . 0.0 112.057 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' B' ' 30' ' ' ARG . 12.6 mm-40 -78.49 -14.51 59.33 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 121.835 0.826 . . . . 0.0 110.249 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' MET . . . . . 0.451 ' O ' ' HG2' ' B' ' 29' ' ' MET . 53.5 ttm 37.02 26.01 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.551 -1.658 . . . . 0.0 112.647 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.506 HH11 ' H ' ' A' ' 121' ' ' THR . 7.7 mmt180 46.29 -158.07 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.753 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.626 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.2 tp10 175.85 132.83 0.04 OUTLIER 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.691 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 57.6 mttt -65.92 102.42 0.78 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.565 0.698 . . . . 0.0 112.133 -178.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.739 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.0 mt -103.94 100.38 10.16 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.581 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.646 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -99.9 92.28 5.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.88 -80.25 0.02 OUTLIER Glycine 0 C--N 1.322 -0.235 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.889 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.467 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 4.1 t-160 -65.19 -55.66 17.32 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 117.337 0.568 . . . . 0.0 111.182 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.439 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.7 m-70 -52.95 -37.53 61.15 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.739 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 25.4 t80 -67.14 -27.94 67.72 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.02 -1.9 . . . . 0.0 109.786 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.522 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.0 OUTLIER -74.46 -65.77 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.226 177.496 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.467 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.2 mpt_? -46.01 -57.97 3.97 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 119.385 -0.341 . . . . 0.0 110.848 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.467 ' O ' ' CG2' ' B' ' 45' ' ' VAL . . . -52.0 -51.74 55.26 Favored 'General case' 0 C--O 1.212 -0.914 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.975 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.629 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -42.45 -38.06 1.79 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.281 0.562 . . . . 0.0 110.473 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.555 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.3 OUTLIER -77.31 -64.78 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.1 179.073 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.437 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 5.0 mtt180 -34.21 -40.8 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 122.464 1.126 . . . . 0.0 109.767 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.791 HG21 ' HA ' ' A' ' 122' ' ' GLN . 60.8 t -74.51 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.778 -179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 9.0 t -121.64 -58.94 1.73 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.538 -176.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.548 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 149.29 -101.51 0.22 Allowed Glycine 0 C--N 1.321 -0.281 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.961 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.455 ' CA ' ' HE1' ' B' ' 51' ' ' TRP . . . 139.1 -134.0 6.5 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.478 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.618 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 57.5 Cg_endo -69.49 -69.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.927 2.418 . . . . 0.0 113.149 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.457 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 0.5 OUTLIER -155.98 -45.66 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.073 0.463 . . . . 0.0 111.279 -179.038 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.618 ' CE2' ' HD2' ' B' ' 49' ' ' PRO . 16.5 m95 63.35 -1.79 0.52 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.578 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' SER . . . . . 0.419 ' H ' ' C ' ' B' ' 50' ' ' ARG . 74.2 m 58.17 171.93 0.06 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.897 0.38 . . . . 0.0 111.419 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 21.1 p -155.59 -46.63 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.93 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -82.67 25.89 0.62 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.102 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.067 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.22 114.33 15.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.314 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -102.83 -159.73 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.709 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.447 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 14.7 t -74.99 -155.72 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.428 ' O ' ' HB3' ' A' ' 114' ' ' TYR . 2.3 m-20 -84.77 101.59 1.68 Allowed Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.47 ' HB2' ' CZ ' ' B' ' 38' ' ' PHE . 41.8 Cg_endo -62.72 0.83 1.29 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.375 2.05 . . . . 0.0 112.989 -178.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.13 -49.62 5.91 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.448 0.642 . . . . 0.0 109.54 178.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.6 mmm180 -78.51 -23.86 46.1 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.911 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.462 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -70.08 -51.21 33.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.773 179.958 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.552 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 4.5 m -75.49 -16.03 60.35 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.679 -0.409 . . . . 0.0 110.957 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.633 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.9 t -71.57 -53.02 15.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.857 0.361 . . . . 0.0 111.272 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.8 mt -79.84 -13.94 59.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.338 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.7 t -129.29 -55.63 1.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.424 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 114.4 144.11 8.5 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 89.8 m -122.03 142.59 50.17 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.471 HG21 ' CG ' ' B' ' 30' ' ' ARG . 73.3 p -75.81 157.05 33.88 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.648 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.656 ' HA ' HG21 ' B' ' 45' ' ' VAL . 18.2 mt-30 -58.83 -14.46 8.92 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.435 ' O ' ' HB2' ' A' ' 126' ' ' LEU . 26.6 mt-30 -74.31 -51.96 13.65 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.61 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.4 OUTLIER -52.66 -57.39 10.22 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.977 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.583 HD13 ' HA ' ' A' ' 122' ' ' GLN . 1.1 mt -54.36 -34.43 61.14 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.488 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 123' ' ' GLN . 6.3 mt -60.76 -32.94 72.22 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.184 0.516 . . . . 0.0 110.001 178.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.429 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -90.94 -9.46 46.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.631 -179.565 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 27.5 mt -92.02 -13.42 30.99 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 120.965 0.412 . . . . 0.0 110.069 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.623 ' HA ' ' HA2' ' B' ' 48' ' ' GLY . 1.6 p -83.64 175.97 4.22 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.134 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.541 ' HD3' ' H ' ' B' ' 48' ' ' GLY . 16.4 Cg_exo -68.19 -159.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.383 2.055 . . . . 0.0 112.388 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.122 -179.995 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.485 0.981 0 N-CA-C 110.957 -0.439 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 61.9 p -72.59 133.81 82.4 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.997 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -97.63 -157.17 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.316 2.677 . . . . 0.0 111.842 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -82.16 75.09 9.1 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.637 0.732 . . . . 0.0 110.433 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 16.6 ttm -80.18 114.93 19.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.827 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.471 ' CG ' HG21 ' A' ' 121' ' ' THR . 5.2 mtt180 -79.7 163.07 24.82 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.021 -178.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.515 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 5.5 tp10 -176.74 139.99 0.32 Allowed 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.937 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -67.42 101.84 1.03 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.387 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.701 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.2 mt -97.26 96.68 8.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.324 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.633 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -97.66 88.7 4.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.049 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.451 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 64.22 -78.23 0.05 OUTLIER Glycine 0 C--N 1.318 -0.426 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.639 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.554 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 5.6 t-160 -66.37 -54.42 24.7 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 117.336 0.568 . . . . 0.0 111.659 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.479 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 6.8 m-70 -54.51 -34.26 61.35 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.701 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 27.3 t80 -71.68 -27.04 62.78 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.167 -1.833 . . . . 0.0 109.654 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.554 ' HB ' ' HA ' ' B' ' 36' ' ' HIS . 2.3 t -73.61 -62.53 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.615 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.409 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.2 OUTLIER -60.72 -42.48 97.35 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.022 179.272 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.472 ' HB2' HD22 ' A' ' 125' ' ' LEU . . . -61.03 -40.85 95.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.438 1.017 . . . . 0.0 109.225 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.6 -47.02 67.21 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.125 0.488 . . . . 0.0 111.28 179.834 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.607 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.1 OUTLIER -76.09 -49.24 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.174 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.443 ' C ' ' HD3' ' B' ' 44' ' ' ARG . 0.0 OUTLIER -43.91 -40.58 4.67 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-O 122.864 1.316 . . . . 0.0 107.764 177.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.656 HG21 ' HA ' ' A' ' 122' ' ' GLN . 56.0 t -74.05 -62.66 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.195 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 49.1 t -141.31 -60.73 0.48 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 113.917 -1.492 . . . . 0.0 111.927 -176.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.607 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 170.87 -90.53 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.46 -178.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.623 ' HA2' ' HA ' ' A' ' 129' ' ' CYS . . . 123.12 -124.4 5.62 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.471 -0.652 . . . . 0.0 111.471 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.569 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 38.2 Cg_endo -65.21 -140.38 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.877 2.384 . . . . 0.0 112.021 178.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.462 ' H ' ' HB2' ' B' ' 49' ' ' PRO . 79.7 mtt180 -80.96 -58.28 3.15 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.569 ' CZ2' ' HD2' ' B' ' 49' ' ' PRO . 35.4 m95 71.76 -10.89 0.8 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.867 -178.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' SER . . . . . 0.41 ' H ' ' C ' ' B' ' 50' ' ' ARG . 56.1 m 62.51 143.07 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.451 -179.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 55.5 p -154.99 -41.92 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.86 24.59 0.73 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.224 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.022 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.269 0 CA-C-O 120.649 0.261 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 63.92 153.93 0.05 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.297 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -116.88 -167.17 1.25 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.25 0.547 . . . . 0.0 111.436 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 12.4 t -78.1 -161.53 0.27 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.108 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -82.71 106.2 6.37 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.49 ' HB2' ' CZ ' ' B' ' 38' ' ' PHE . 31.2 Cg_endo -60.13 -14.93 31.2 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.165 1.91 . . . . 0.0 112.812 -178.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -72.36 -49.17 36.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.254 0.549 . . . . 0.0 110.118 179.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.7 OUTLIER -78.3 -35.15 48.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.879 178.901 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.489 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -59.97 -56.66 18.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.135 179.842 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.543 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 9.3 m -69.38 -16.41 63.51 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.287 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.625 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -71.34 -46.72 59.9 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.599 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 9.0 mt -80.58 -16.59 53.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 80.5 p -133.68 -51.48 0.85 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.409 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 117.98 160.85 11.75 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.521 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.433 ' HB2' HD11 ' B' ' 33' ' ' LEU . 92.1 m -136.89 143.46 43.0 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.461 HG21 ' CG ' ' B' ' 30' ' ' ARG . 82.3 p -80.82 161.29 24.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.554 179.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.748 ' HA ' HG21 ' B' ' 45' ' ' VAL . 27.8 mt-30 -58.28 -15.17 9.17 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.446 ' O ' HG23 ' A' ' 127' ' ' THR . 25.5 mt-30 -73.77 -54.68 7.49 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.583 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -54.45 -55.33 29.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.848 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.481 HD23 HD13 ' B' ' 33' ' ' LEU . 1.1 mp -58.83 -31.08 68.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.965 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 6.8 mt -64.77 -27.6 69.01 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.866 0.365 . . . . 0.0 110.158 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -97.94 -6.52 32.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.266 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 40.7 mt -94.76 -16.2 23.22 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.748 0.309 . . . . 0.0 110.702 -179.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 30.6 p -73.88 154.66 88.99 Favored Pre-proline 0 CA--C 1.529 0.152 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.775 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -81.48 17.34 1.51 Allowed 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.218 2.612 . . . . 0.0 112.465 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.998 179.917 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 111.112 -0.38 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 4.1 t -165.42 143.13 4.91 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.112 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -94.11 70.76 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.132 2.555 . . . . 0.0 112.17 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.434 ' OE2' ' HG3' ' A' ' 123' ' ' GLN . 1.3 mt-10 38.69 69.26 0.28 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.403 0.621 . . . . 0.0 111.535 -179.155 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 39.4 ttp -82.7 16.39 2.22 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.038 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.461 ' CG ' HG21 ' A' ' 121' ' ' THR . 5.5 mtt180 55.77 174.28 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.162 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.559 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.0 tp10 -178.64 136.25 0.15 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.399 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -64.65 102.54 0.58 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.793 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.736 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 34.2 mt -99.58 104.88 16.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.14 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.625 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.6 OUTLIER -103.26 95.31 6.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.447 0.641 . . . . 0.0 111.124 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.432 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 58.97 -87.66 0.02 OUTLIER Glycine 0 C--O 1.227 -0.299 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.17 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.494 ' HD2' HG11 ' B' ' 39' ' ' VAL . 18.7 t-160 -59.02 -56.63 19.8 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 117.206 0.503 . . . . 0.0 111.597 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -48.74 -48.78 40.38 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.736 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 22.6 t80 -55.94 -31.28 62.8 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 112.994 -1.912 . . . . 0.0 110.424 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.564 ' O ' HG21 ' B' ' 43' ' ' VAL . 0.5 OUTLIER -72.79 -45.04 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.787 178.189 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' B' ' 36' ' ' HIS . 1.9 mtt180 -61.09 -61.03 2.87 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.879 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.513 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -52.68 -45.56 66.88 Favored 'General case' 0 C--O 1.208 -1.098 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.583 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -45.84 -38.65 7.53 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.349 0.595 . . . . 0.0 109.724 179.433 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.647 HG13 ' HA2' ' B' ' 47' ' ' GLY . 0.4 OUTLIER -76.72 -63.41 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.4 178.79 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtm180 -36.7 -40.62 0.27 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.439 1.114 . . . . 0.0 110.195 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.748 HG21 ' HA ' ' A' ' 122' ' ' GLN . 99.4 t -75.19 -65.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 112.949 -1.932 . . . . 0.0 113.4 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t -109.63 -38.2 5.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.613 -176.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.647 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 101.02 7.5 50.0 Favored Glycine 0 CA--C 1.506 -0.512 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.421 -178.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' B' ' 47' ' ' GLY . . . 28.91 -133.36 0.06 OUTLIER Glycine 0 C--N 1.335 0.519 0 O-C-N 124.083 0.52 . . . . 0.0 113.51 179.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.54 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 60.3 Cg_endo -69.65 -136.85 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.518 0 C-N-CA 122.926 2.417 . . . . 0.0 112.368 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.468 ' H ' ' HB2' ' B' ' 49' ' ' PRO . 32.6 mtt180 -81.78 -53.98 5.75 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.567 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 49.1 m95 71.2 1.42 3.82 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.157 -178.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 2.6 m -147.4 105.98 3.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.889 0.376 . . . . 0.0 111.099 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 15.3 p -156.86 82.75 0.95 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.828 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.86 -8.19 58.88 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.896 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.433 -179.945 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.796 0.331 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -132.65 165.67 23.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.204 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -133.34 -144.88 0.23 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.89 -179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 9.7 t -74.79 -140.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.314 179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -79.69 112.62 30.74 Favored Pre-proline 0 C--N 1.328 -0.344 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.534 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 42.7 Cg_endo -64.57 -10.99 26.57 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.292 1.994 . . . . 0.0 112.817 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.28 -46.27 6.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.948 0.404 . . . . 0.0 111.706 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.5 OUTLIER -76.89 -40.5 47.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.654 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.534 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -59.83 -34.82 73.58 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.811 -179.39 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.703 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 73.5 m -77.5 -21.05 53.35 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.071 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.607 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.3 t -65.41 -43.4 90.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 20.9 mt -84.29 -20.71 31.69 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.215 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 43.2 t -127.53 -75.86 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 111.364 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.703 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 132.76 155.03 7.73 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.124 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.646 ' SG ' HD11 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -114.48 149.75 35.87 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.538 0.685 . . . . 0.0 112.273 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.488 ' HB ' ' HB2' ' B' ' 28' ' ' GLU . 39.0 p -87.89 150.86 23.24 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.051 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.701 ' HA ' HG21 ' B' ' 45' ' ' VAL . 24.3 mt-30 -53.06 -19.22 2.58 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.476 ' O ' ' HB2' ' A' ' 126' ' ' LEU . 0.0 OUTLIER -72.55 -53.61 11.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.488 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 6.0 t70 -55.1 -52.18 64.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.595 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.1 mt -59.01 -31.9 69.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.856 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.5 ' N ' HG12 ' B' ' 45' ' ' VAL . 7.7 mt -63.3 -28.94 70.36 Favored 'General case' 0 C--O 1.231 0.095 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.052 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.09 -3.89 36.97 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.376 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 31.1 mt -91.24 -21.34 21.15 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.759 0.314 . . . . 0.0 110.444 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.451 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 2.9 p -79.22 166.11 44.02 Favored Pre-proline 0 C--O 1.232 0.14 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.14 178.198 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -81.3 -169.06 0.71 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.982 2.455 . . . . 0.0 111.956 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.312 -0.851 . . . . 0.0 111.233 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . 0.449 ' H2 ' ' H ' ' B' ' 26' ' ' THR . 3.8 Cg_exo . . . . . 0 N--CA 1.485 1.028 0 N-CA-C 111.344 -0.291 . . . . 0.0 111.344 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.449 ' H ' ' H2 ' ' B' ' 25' ' ' PRO . 68.0 p -73.74 135.93 77.58 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.901 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -95.97 -159.31 0.05 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 123.043 2.495 . . . . 0.0 111.676 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.488 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 3.9 pt-20 -81.0 77.93 7.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.736 0.779 . . . . 0.0 110.324 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 39.7 ttp -83.28 15.55 2.89 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.865 -179.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.433 ' HG3' ' CG2' ' A' ' 121' ' ' THR . 0.0 OUTLIER 36.81 84.43 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.001 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.504 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.3 pt-20 -107.49 154.44 21.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.62 0.724 . . . . 0.0 111.325 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 118' ' ' SER . 79.8 mttt -60.19 104.94 0.36 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.288 -1.324 . . . . 0.0 112.604 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.753 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 63.9 mt -101.33 98.79 9.12 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.186 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.607 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.3 t -94.9 78.32 3.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.388 0.613 . . . . 0.0 111.19 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 67.43 -75.15 0.2 Allowed Glycine 0 C--N 1.32 -0.319 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.744 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.482 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.5 t-160 -65.81 -52.23 52.35 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 117.237 0.519 . . . . 0.0 110.912 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.517 ' HB3' HD22 ' B' ' 33' ' ' LEU . 10.8 m170 -55.44 -36.99 67.11 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 176.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.753 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 39.4 t80 -67.21 -27.3 67.14 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 112.987 -1.915 . . . . 0.0 109.683 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.486 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.6 t -73.13 -66.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-N 115.118 -0.947 . . . . 0.0 108.811 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.443 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 2.5 mpt_? -48.65 -59.64 3.37 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 119.267 -0.396 . . . . 0.0 110.461 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.458 ' O ' ' CG2' ' B' ' 45' ' ' VAL . . . -48.45 -43.81 34.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.805 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.65 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.94 -42.85 65.84 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 121.033 0.444 . . . . 0.0 110.332 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.674 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -74.45 -59.5 3.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.128 179.214 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mmm180 -33.56 -40.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.437 1.113 . . . . 0.0 108.504 176.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.701 HG21 ' HA ' ' A' ' 122' ' ' GLN . 75.0 t -75.84 -65.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 112.997 -1.91 . . . . 0.0 111.751 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.451 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 31.8 t -135.74 -61.67 0.71 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.225 -1.352 . . . . 0.0 111.671 -176.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.674 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 120.62 110.67 2.24 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.339 -0.846 . . . . 0.0 113.168 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.04 -97.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.954 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.622 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 77.1 Cg_endo -75.84 -161.07 0.12 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.839 3.026 . . . . 0.0 110.987 178.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.42 -18.92 30.51 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.663 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 18.7 m95 62.38 6.45 1.92 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.881 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 4.6 m -113.96 112.31 23.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.903 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 19.0 p -155.38 81.62 1.05 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.943 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 45.45 -160.92 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.651 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.079 179.857 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.779 0.323 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -151.66 1.63 0.37 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.159 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -107.94 128.33 54.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.282 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 33.79 -99.07 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.331 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.402 ' HA ' ' HD2' ' A' ' 111' ' ' PRO . 3.0 m120 -155.42 96.73 2.42 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.54 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.45 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 27.2 Cg_endo -58.74 89.85 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 121.984 1.789 . . . . 0.0 111.229 -179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.45 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 160.76 -63.34 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 114.52 -1.218 . . . . 0.0 107.841 -179.103 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.06 -16.46 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.979 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.409 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -73.25 -46.1 52.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.599 179.643 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.563 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.2 m -83.06 -20.64 34.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.391 . . . . 0.0 110.825 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.652 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.4 t -69.72 -50.31 44.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.6 mt -80.95 -14.88 57.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.024 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 27.2 t -131.91 -59.23 0.95 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.493 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.3 147.48 7.89 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 -178.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 94.4 m -123.06 145.0 48.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.442 HG21 ' CG ' ' B' ' 30' ' ' ARG . 39.9 p -82.21 157.91 23.77 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.742 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.648 ' HA ' HG21 ' B' ' 45' ' ' VAL . 7.0 mt-30 -56.85 -18.61 13.67 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.447 ' O ' HG23 ' A' ' 127' ' ' THR . 47.2 mt-30 -72.15 -52.07 18.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.56 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.3 OUTLIER -54.62 -57.01 13.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.471 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.483 ' HB3' ' HA ' ' B' ' 42' ' ' LEU . 1.3 mp -59.26 -28.87 67.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.144 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.417 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 7.1 mt -66.79 -27.01 67.23 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.857 0.36 . . . . 0.0 110.084 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.447 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -100.95 -3.73 28.96 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.354 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 28.2 mt -93.35 -20.79 20.02 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 120.854 0.359 . . . . 0.0 110.369 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 27.7 p -66.8 155.16 90.3 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.401 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -77.4 160.57 32.18 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.115 2.543 . . . . 0.0 112.24 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.362 -0.828 . . . . 0.0 111.101 -179.885 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . 0.459 ' H2 ' ' H ' ' B' ' 26' ' ' THR . 3.1 Cg_endo . . . . . 0 N--CA 1.485 0.984 0 N-CA-C 111.475 -0.241 . . . . 0.0 111.475 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.459 ' H ' ' H2 ' ' B' ' 25' ' ' PRO . 2.5 t -73.25 141.9 81.33 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.167 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -94.2 -160.04 0.07 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.124 2.55 . . . . 0.0 112.41 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.32 56.89 3.97 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.959 0.885 . . . . 0.0 111.493 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.76 110.77 9.32 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.771 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.442 ' CG ' HG21 ' A' ' 121' ' ' THR . 6.6 mtt180 -75.6 161.42 29.14 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.19 -0.913 . . . . 0.0 112.095 -178.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.585 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.2 tp10 -169.36 141.87 2.57 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.788 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -69.86 102.74 2.02 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.688 0.756 . . . . 0.0 111.612 -178.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.738 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.2 mt -100.91 101.59 12.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.386 -1.279 . . . . 0.0 111.743 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.652 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -98.6 91.25 5.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.305 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.72 -79.5 0.01 OUTLIER Glycine 0 C--N 1.321 -0.258 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.914 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.453 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 3.4 t-160 -63.6 -54.94 28.08 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.106 0.453 . . . . 0.0 111.191 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -54.96 -38.31 67.6 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.738 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 26.5 t80 -65.25 -26.99 68.34 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.062 -1.881 . . . . 0.0 109.626 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.542 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.4 t -74.38 -65.11 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.452 ' O ' ' HG3' ' B' ' 44' ' ' ARG . 0.1 OUTLIER -43.69 -62.37 1.12 Allowed 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 123.259 0.349 . . . . 0.0 110.721 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.558 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -50.54 -50.85 52.27 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 119.807 -0.757 . . . . 0.0 109.032 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.657 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -42.39 -38.93 2.02 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.374 0.607 . . . . 0.0 110.267 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.591 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.3 OUTLIER -78.59 -67.58 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.272 178.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 10.0 mtt180 -32.26 -42.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 122.396 1.093 . . . . 0.0 110.35 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.648 HG21 ' HA ' ' A' ' 122' ' ' GLN . 92.5 t -73.04 -59.87 2.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 113.106 -1.861 . . . . 0.0 112.924 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 13.5 t -122.57 -52.79 1.91 Allowed 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.137 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.591 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 111.89 96.06 2.29 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.096 -177.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.627 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . -59.12 -133.53 0.01 OUTLIER Glycine 0 CA--C 1.523 0.581 0 C-N-CA 121.37 -0.443 . . . . 0.0 113.594 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.526 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 38.9 Cg_endo -85.79 104.29 0.77 Allowed 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.551 2.834 . . . . 0.0 114.781 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 51.51 -71.12 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 176.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.627 ' HE1' ' N ' ' B' ' 48' ' ' GLY . 30.1 m95 73.23 4.64 4.93 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.058 0.543 . . . . 0.0 111.281 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 45.8 m -101.99 146.04 28.44 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.07 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -159.95 -57.21 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.185 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -81.95 39.1 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.987 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.371 -0.823 . . . . 0.0 111.275 -179.771 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.685 0.279 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 63.35 111.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.446 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -103.26 -122.45 0.19 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.983 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.408 ' CG2' ' H ' ' A' ' 110' ' ' ASN . 1.3 t -159.67 -57.74 0.06 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.373 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.408 ' H ' ' CG2' ' A' ' 109' ' ' THR . 17.3 m120 -157.05 85.32 2.9 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.339 179.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.623 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 39.5 Cg_endo -60.37 -8.46 8.71 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.516 2.144 . . . . 0.0 113.424 -177.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -90.34 -44.97 9.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.397 0.618 . . . . 0.0 110.157 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -79.83 -54.11 6.14 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.409 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.623 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -50.61 -32.06 17.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.144 -179.489 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.584 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 72.7 m -85.42 -34.66 21.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.568 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.59 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.0 t -51.11 -36.43 40.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.223 0.535 . . . . 0.0 109.602 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 75.6 mt -81.41 -59.0 2.79 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.245 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.8 m -101.59 -57.03 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.836 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.584 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 124.39 163.14 11.61 Favored Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.624 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.709 ' SG ' HD11 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -111.86 167.98 9.94 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.453 0.644 . . . . 0.0 111.432 179.802 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 123' ' ' GLN . 42.3 p -103.44 155.28 18.62 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 114.755 -1.111 . . . . 0.0 109.496 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.715 ' HA ' HG21 ' B' ' 45' ' ' VAL . 31.2 mt-30 -58.84 -5.75 0.66 Allowed 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.55 HE21 HD12 ' A' ' 126' ' ' LEU . 1.4 mp0 -88.42 -51.78 5.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.582 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t70 -55.01 -56.2 22.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.655 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.1 mt -56.01 -32.05 63.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.714 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.55 HD12 HE21 ' A' ' 123' ' ' GLN . 5.8 mt -62.7 -30.59 71.51 Favored 'General case' 0 CA--C 1.524 -0.053 0 CA-C-O 121.028 0.442 . . . . 0.0 110.191 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.42 -5.25 40.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.559 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 31.9 mt -92.65 -21.29 20.11 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.992 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 30.3 p -66.94 153.29 94.65 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.764 179.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -78.18 6.07 4.96 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.16 2.573 . . . . 0.0 112.476 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.846 -179.999 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo . . . . . 0 N--CA 1.485 1.029 0 N-CA-C 111.145 -0.367 . . . . 0.0 111.145 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.429 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 14.9 p 61.92 133.21 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.602 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 84.5 Cg_endo -97.09 -157.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.972 0 C-N-CA 123.167 2.578 . . . . 0.0 111.76 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -80.92 76.35 7.86 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.587 0.708 . . . . 0.0 110.228 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 8.4 ttt -80.74 115.43 20.24 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.182 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.431 ' CG ' HG21 ' A' ' 121' ' ' THR . 5.8 mtt180 -80.28 151.82 29.36 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.492 -179.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.627 ' HG3' HD21 ' B' ' 33' ' ' LEU . 10.9 pt-20 -163.75 136.51 5.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.592 0.71 . . . . 0.0 110.936 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 82.0 mttt -55.54 117.5 3.64 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.322 -1.308 . . . . 0.0 112.478 -178.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.773 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 21.4 mt -116.93 100.91 8.08 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.183 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.59 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 83.2 m -95.79 76.78 3.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.27 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.477 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.34 -81.98 0.2 Allowed Glycine 0 C--O 1.229 -0.193 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.842 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.532 ' O ' ' HG3' ' B' ' 40' ' ' ARG . 11.3 t-160 -60.27 -53.41 57.99 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 117.285 0.542 . . . . 0.0 110.725 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.574 ' HA ' ' HE ' ' B' ' 40' ' ' ARG . 13.1 m-70 -52.58 -45.13 66.33 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.773 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 24.2 t80 -56.03 -29.36 60.3 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 113.104 -1.862 . . . . 0.0 109.85 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.574 ' O ' HG21 ' B' ' 43' ' ' VAL . 0.9 OUTLIER -73.09 -57.63 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.387 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.574 ' HE ' ' HA ' ' B' ' 37' ' ' HIS . 23.9 mtm180 -44.92 -66.7 0.36 Allowed 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.159 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.516 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -51.08 -46.5 61.8 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.655 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.82 -39.11 17.43 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.265 0.555 . . . . 0.0 109.792 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.595 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.7 OUTLIER -73.22 -65.03 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.95 178.238 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.4 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 2.1 mtt180 -34.94 -41.04 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.165 177.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.715 HG21 ' HA ' ' A' ' 122' ' ' GLN . 66.5 t -74.46 -61.86 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 113.34 -1.755 . . . . 0.0 112.89 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 8.9 t -119.54 -54.58 2.16 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.368 -176.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.532 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 142.45 -115.53 0.96 Allowed Glycine 0 C--N 1.318 -0.453 0 CA-C-N 114.61 -1.177 . . . . 0.0 111.719 -178.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.479 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 153.92 -142.57 9.25 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.627 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.566 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 97.7 Cg_endo -79.18 42.59 1.32 Allowed 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.888 2.392 . . . . 0.0 112.55 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 68.51 -25.55 0.14 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.595 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 11.4 m95 57.67 9.13 0.77 Allowed 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 178.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' SER . . . . . 0.497 ' O ' ' N ' ' B' ' 54' ' ' GLU . 64.6 m 53.6 -100.07 0.1 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.224 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 28.1 p 50.03 -79.8 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.628 0.58 . . . . 0.0 112.171 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' B' ' 52' ' ' SER . 20.0 mm-40 -81.66 28.83 0.39 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.14 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.356 -0.83 . . . . 0.0 111.028 179.89 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.7 0.286 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.26 150.39 23.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.941 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -106.34 -165.58 1.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.133 0.492 . . . . 0.0 111.475 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 15.3 t -76.4 -145.54 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.488 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -79.34 119.22 76.29 Favored Pre-proline 0 C--N 1.331 -0.21 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.579 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 60.9 Cg_endo -69.69 -10.31 28.29 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.329 2.019 . . . . 0.0 113.021 -179.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.47 -43.8 8.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.098 0.475 . . . . 0.0 111.336 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -77.1 -48.41 17.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.926 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.579 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -55.22 -30.58 60.27 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.095 -179.248 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.597 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 70.7 m -84.01 -29.0 27.3 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.19 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.606 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 51.4 t -54.94 -42.73 72.67 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.0 mt -81.51 -46.48 14.43 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.926 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.0 m -102.92 -74.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.1 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.597 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 135.1 156.93 7.84 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.589 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.667 ' HB2' HD11 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -108.46 168.07 9.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.522 0.677 . . . . 0.0 111.765 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.459 ' C ' ' H ' ' A' ' 123' ' ' GLN . 26.9 p -107.69 158.67 17.08 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.696 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.704 ' HA ' HG21 ' B' ' 45' ' ' VAL . 30.4 mt-30 -62.57 -2.38 1.07 Allowed 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.459 ' H ' ' C ' ' A' ' 121' ' ' THR . 27.1 mt-30 -90.65 -57.07 2.95 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 176.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.516 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.5 OUTLIER -54.44 -53.39 54.82 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.304 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.667 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.2 mt -56.05 -36.37 67.96 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.789 178.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.579 HD22 ' HB2' ' B' ' 46' ' ' CYS . 5.6 mt -62.27 -31.06 71.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 120.974 0.416 . . . . 0.0 109.942 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -90.19 -7.72 52.91 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.47 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.56 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.4 mt -94.99 -13.56 25.16 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.148 0.499 . . . . 0.0 109.984 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.418 ' SG ' ' CD ' ' A' ' 130' ' ' PRO . 1.6 t -51.64 157.25 1.93 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.917 178.096 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.418 ' CD ' ' SG ' ' A' ' 129' ' ' CYS . 2.4 Cg_endo -84.45 9.84 3.97 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 123.407 2.738 . . . . 0.0 112.087 -179.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.815 179.928 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo . . . . . 0 N--CA 1.484 0.93 0 N-CA-C 111.034 -0.41 . . . . 0.0 111.034 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -162.61 148.53 10.21 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.923 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -89.57 85.95 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.834 2.356 . . . . 0.0 112.352 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 34.98 52.19 0.59 Allowed 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 121.611 0.72 . . . . 0.0 111.961 -179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.5 tpt -76.73 110.37 11.26 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.202 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -75.43 125.89 29.9 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.397 -1.274 . . . . 0.0 111.661 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.605 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.0 pt-20 -137.42 144.65 42.48 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.515 0.674 . . . . 0.0 110.846 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.524 ' HZ1' ' HB3' ' B' ' 32' ' ' LYS . 4.6 mtpm? -60.4 106.58 0.55 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.394 -1.276 . . . . 0.0 112.421 -177.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.749 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 60.1 mt -106.14 98.19 7.91 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.945 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.606 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.6 m -93.22 71.05 4.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.214 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.425 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.7 -75.18 0.57 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.443 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.526 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 7.8 t-160 -64.27 -51.35 63.98 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 117.133 0.466 . . . . 0.0 110.569 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.506 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 13.2 m-70 -56.13 -39.18 71.85 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.749 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 38.4 t80 -63.46 -26.4 68.71 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.216 179.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.538 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.6 t -74.57 -67.28 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.79 176.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.433 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.7 OUTLIER -45.37 -58.47 3.3 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.207 0.317 . . . . 0.0 110.51 178.898 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.529 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -50.1 -51.86 39.5 Favored 'General case' 0 C--O 1.214 -0.81 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.58 -44.67 8.98 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.313 0.578 . . . . 0.0 110.465 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.679 HG13 ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -69.34 -62.65 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.898 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -35.56 -39.83 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.849 -1.068 . . . . 0.0 109.684 177.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.704 HG21 ' HA ' ' A' ' 122' ' ' GLN . 57.3 t -74.13 -58.19 5.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.904 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.579 ' HB2' HD22 ' A' ' 126' ' ' LEU . 39.5 t -129.27 -64.91 0.88 Allowed 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.853 -177.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.679 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 161.25 -118.82 0.85 Allowed Glycine 0 N--CA 1.45 -0.43 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.433 -178.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.509 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 157.62 -141.7 7.99 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.301 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.542 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 92.5 Cg_endo -79.01 43.4 1.47 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.84 2.36 . . . . 0.0 112.433 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 68.47 -26.69 0.14 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.232 0.613 . . . . 0.0 112.555 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.602 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 9.5 m95 58.29 9.22 0.96 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 6.3 m -126.3 -165.46 1.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.337 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 72.1 p 48.95 87.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.152 0.501 . . . . 0.0 111.156 -179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 41.55 85.17 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.622 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.116 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.788 0.328 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.97 120.76 15.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.154 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.422 ' O ' HG21 ' A' ' 109' ' ' THR . . . -105.72 125.09 50.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.213 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.422 HG21 ' O ' ' A' ' 108' ' ' ALA . 9.1 t 34.15 -129.6 0.07 Allowed 'General case' 0 CA--C 1.53 0.209 0 O-C-N 123.622 0.576 . . . . 0.0 111.073 179.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -88.61 104.08 6.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.503 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 72.8 Cg_endo -69.89 -13.0 33.75 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.299 1.999 . . . . 0.0 112.781 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.38 -44.94 8.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.539 -179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.9 mmt180 -77.38 -45.29 26.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.954 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.503 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -58.13 -28.49 64.72 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.956 -179.16 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.659 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 98.7 m -84.68 -24.09 29.12 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.9 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.64 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.6 t -60.57 -45.18 94.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.96 -40.84 23.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.498 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.8 t -101.68 -78.45 0.53 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.391 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.659 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.2 147.35 6.32 Favored Glycine 0 C--O 1.228 -0.261 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.732 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.624 ' SG ' HD11 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -109.85 142.4 41.2 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.081 0.467 . . . . 0.0 110.86 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.778 HG23 ' HB2' ' B' ' 28' ' ' GLU . 10.7 p -72.01 -91.12 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 122.333 1.063 . . . . 0.0 111.453 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.622 ' HA ' HG21 ' B' ' 45' ' ' VAL . 9.7 mt-30 -156.28 -30.64 0.09 Allowed 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.986 -1.915 . . . . 0.0 108.546 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.446 ' O ' HG23 ' A' ' 127' ' ' THR . 49.3 mt-30 -63.66 -49.08 74.61 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.532 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 31.5 t70 -57.05 -56.46 21.44 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.564 HD11 ' HB2' ' A' ' 120' ' ' CYS . 1.1 mt -58.3 -25.33 61.73 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.76 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.426 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 11.2 mt -71.77 -30.87 66.04 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.874 0.369 . . . . 0.0 110.338 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -92.1 -7.28 49.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.232 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 24.1 mt -95.48 -22.76 17.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.763 0.316 . . . . 0.0 110.919 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 17.4 p -69.45 164.81 46.22 Favored Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.511 178.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_exo -72.76 159.98 47.26 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.709 2.272 . . . . 0.0 111.865 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.049 -179.781 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo . . . . . 0 N--CA 1.485 0.994 0 N-CA-C 110.991 -0.427 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 56.1 p -72.9 135.46 80.51 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.269 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -95.59 -159.05 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.001 2.467 . . . . 0.0 111.527 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.778 ' HB2' HG23 ' A' ' 121' ' ' THR . 4.9 pt-20 -81.48 74.22 8.49 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.793 0.806 . . . . 0.0 110.047 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.2 tpt -85.1 112.0 20.27 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.248 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.47 ' HD3' ' O ' ' A' ' 119' ' ' GLY . 13.7 mtt180 -76.4 110.16 10.7 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.718 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.596 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 10.1 tp10 -115.23 142.45 46.66 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.303 0.573 . . . . 0.0 111.713 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 76.7 mttt -63.27 102.23 0.38 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.912 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.746 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 60.4 mt -101.16 102.37 13.28 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.911 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.3 t -97.84 76.0 2.42 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.412 0.625 . . . . 0.0 111.355 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.419 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.35 -73.91 0.56 Allowed Glycine 0 C--N 1.319 -0.416 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.678 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.464 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.2 t-160 -67.73 -52.86 32.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 117.142 0.471 . . . . 0.0 111.002 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.531 ' HB3' HD22 ' B' ' 33' ' ' LEU . 10.7 m170 -54.58 -36.22 64.15 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 176.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.746 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 41.7 t80 -66.67 -29.62 69.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 112.96 -1.927 . . . . 0.0 109.517 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.509 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.9 t -71.88 -68.25 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.305 -0.861 . . . . 0.0 108.694 177.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.446 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.2 mpt_? -45.53 -56.7 4.81 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 119.523 -0.275 . . . . 0.0 110.316 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.549 ' O ' HG22 ' B' ' 45' ' ' VAL . . . -51.31 -51.61 52.72 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.078 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.641 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.14 -46.53 5.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.413 0.625 . . . . 0.0 110.303 179.852 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.607 HG13 ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -68.76 -64.71 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.179 179.101 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -34.08 -41.64 0.11 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.249 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.622 HG21 ' HA ' ' A' ' 122' ' ' GLN . 71.5 t -74.26 -60.22 2.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 113.304 -1.771 . . . . 0.0 112.682 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 t -123.69 -59.58 1.52 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.522 -176.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.607 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 152.29 -113.12 0.56 Allowed Glycine 0 N--CA 1.452 -0.266 0 CA-C-N 114.775 -1.102 . . . . 0.0 112.359 -178.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.45 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 150.33 -144.14 11.54 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.429 -0.891 . . . . 0.0 112.606 -179.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.552 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 86.8 Cg_endo -81.34 45.76 2.07 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.882 2.388 . . . . 0.0 112.604 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 68.23 -27.55 0.14 Allowed 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.584 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 17.1 m95 58.43 10.29 1.3 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' SER . . . . . 0.47 ' O ' ' N ' ' B' ' 54' ' ' GLU . 4.0 m -109.98 -173.5 2.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.966 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 69.4 p 53.01 -79.03 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.86 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . 0.47 ' N ' ' O ' ' B' ' 52' ' ' SER . 26.9 tt0 -159.08 134.91 8.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.6 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.084 179.921 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.774 0.321 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -144.74 -16.63 0.53 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.046 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.85 -168.18 1.41 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.103 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.46 -84.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.305 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.424 ' HA ' ' HD2' ' A' ' 111' ' ' PRO . 2.2 m120 -156.28 97.49 2.21 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.275 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.441 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 19.3 Cg_endo -56.4 90.26 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.089 1.859 . . . . 0.0 111.536 -179.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 159.46 -64.24 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 114.387 -1.279 . . . . 0.0 107.867 -179.185 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 2.3 mpp_? -77.29 -20.96 54.29 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.405 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -65.4 -41.68 93.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.981 179.028 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.567 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 2.2 m -92.72 -22.65 19.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.09 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.598 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.1 t -65.02 -36.26 83.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.913 0.387 . . . . 0.0 110.516 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.68 -46.34 15.73 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.856 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 31.7 m -117.37 -44.64 2.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.402 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 119.84 163.72 12.34 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.557 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.404 ' O ' HD11 ' B' ' 33' ' ' LEU . 81.9 m -134.08 139.04 45.7 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.354 0.597 . . . . 0.0 112.321 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.511 ' HB ' ' HB2' ' B' ' 28' ' ' GLU . 58.8 p -75.41 154.01 37.37 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.695 179.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.651 ' HA ' HG21 ' B' ' 45' ' ' VAL . 13.4 mt-30 -53.38 -19.9 3.95 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.624 HE21 HD12 ' A' ' 126' ' ' LEU . 8.3 mm-40 -68.98 -52.77 25.48 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.522 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.24 -54.01 48.79 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.392 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.514 ' HB3' ' HA ' ' B' ' 42' ' ' LEU . 1.4 mp -59.55 -29.87 68.22 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.451 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.624 HD12 HE21 ' A' ' 123' ' ' GLN . 7.5 mt -64.04 -29.97 71.07 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 178.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.36 -0.28 35.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.408 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 52.0 mt -92.01 -23.58 19.48 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.667 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.47 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 18.4 p -71.19 156.88 91.26 Favored Pre-proline 0 C--O 1.232 0.147 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.63 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 2.3 Cg_endo -82.66 15.06 2.13 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.136 2.557 . . . . 0.0 112.736 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.904 179.944 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo . . . . . 0 N--CA 1.482 0.823 0 N-CA-C 111.195 -0.348 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 74.1 p -73.28 133.28 81.1 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.991 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -95.41 67.43 0.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.945 2.43 . . . . 0.0 112.129 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.511 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 8.8 pt-20 36.53 73.24 0.09 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.839 0.828 . . . . 0.0 111.333 -178.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 43.0 ttm -82.35 13.69 3.42 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.086 -179.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 34.14 96.37 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.184 -0.916 . . . . 0.0 113.157 178.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.546 ' HG3' HD21 ' B' ' 33' ' ' LEU . 11.6 pt-20 -119.56 156.74 29.76 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.104 0.478 . . . . 0.0 110.252 178.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -61.31 108.15 0.88 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.179 -0.919 . . . . 0.0 113.168 -177.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.727 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.3 mt -103.87 96.8 6.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.896 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.598 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 5.0 t -96.27 90.56 5.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.36 0.6 . . . . 0.0 111.254 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.428 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.71 -78.71 0.02 OUTLIER Glycine 0 C--N 1.321 -0.255 0 CA-C-N 114.849 -1.069 . . . . 0.0 112.973 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.48 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 3.5 t-160 -66.06 -52.62 47.29 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.449 0.624 . . . . 0.0 111.215 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.457 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 4.4 m-70 -55.82 -35.64 66.57 Favored 'General case' 0 CA--C 1.501 -0.906 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 177.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.727 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 28.2 t80 -68.86 -26.73 65.29 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 112.962 -1.926 . . . . 0.0 109.433 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.497 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.4 t -74.17 -67.12 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.852 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.452 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.6 mpt_? -44.74 -61.6 1.52 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.627 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.459 ' HA ' ' HG3' ' B' ' 44' ' ' ARG . . . -49.43 -45.76 46.86 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 119.861 -0.735 . . . . 0.0 109.548 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.3 OUTLIER -49.78 -41.16 43.65 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.065 0.46 . . . . 0.0 110.346 179.507 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.685 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -75.79 -61.67 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.292 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.459 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 5.2 mtt180 -33.19 -41.48 0.07 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.547 1.165 . . . . 0.0 108.853 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.651 HG21 ' HA ' ' A' ' 122' ' ' GLN . 82.5 t -74.99 -68.57 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-N 112.871 -1.968 . . . . 0.0 112.621 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.47 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 8.5 t -127.77 -60.44 1.16 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.866 -175.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.685 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 110.86 95.72 2.32 Favored Glycine 0 N--CA 1.453 -0.172 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.956 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.63 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . -50.88 -97.99 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.376 -0.44 . . . . 0.0 113.125 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.527 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 19.2 Cg_endo -89.83 175.16 3.14 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 124.573 3.515 . . . . 0.0 111.094 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -81.9 112.8 19.34 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.899 1.333 . . . . 0.0 109.54 178.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.605 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 9.9 m95 -72.82 -77.78 0.1 Allowed 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 112.184 -2.28 . . . . 0.0 113.294 -177.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 22.2 m -152.42 132.43 13.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.116 0.484 . . . . 0.0 111.93 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.9 p -155.69 77.07 0.96 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.277 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -82.54 -2.26 53.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.015 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.313 179.993 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.736 0.303 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.69 4.96 52.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.124 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -131.75 -160.81 1.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.082 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -85.82 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.247 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.43 ' O ' ' HB3' ' A' ' 114' ' ' TYR . 15.3 m120 -153.21 86.7 4.03 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.51 ' HB2' ' CZ ' ' B' ' 38' ' ' PHE . 28.0 Cg_endo -57.58 -4.46 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.869 2.379 . . . . 0.0 113.795 -177.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.2 -49.62 6.88 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.486 0.66 . . . . 0.0 109.722 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -78.77 -26.24 44.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.182 178.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.485 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -70.54 -55.25 9.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.966 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.557 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 10.0 m -68.89 -24.4 64.32 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.242 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.625 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 38.0 t -61.3 -52.89 62.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.813 0.339 . . . . 0.0 111.15 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.0 mt -79.2 -34.72 42.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.056 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 m -106.4 -59.88 1.73 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.49 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.72 162.14 11.65 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.508 ' HB2' HD11 ' B' ' 33' ' ' LEU . 73.2 m -143.02 147.09 34.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.799 0.799 . . . . 0.0 112.882 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.538 ' HG1' ' HB2' ' A' ' 123' ' ' GLN . 29.5 p -87.64 169.78 11.84 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.005 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.761 ' HA ' HG21 ' B' ' 45' ' ' VAL . 28.5 mt-30 -66.63 3.46 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.368 178.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.538 ' HB2' ' HG1' ' A' ' 121' ' ' THR . 25.3 mt-30 -94.31 -54.83 3.4 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.552 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -56.33 -53.4 57.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.574 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.594 ' HB2' HG13 ' B' ' 45' ' ' VAL . 1.0 OUTLIER -56.75 -33.09 66.23 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.32 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.481 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.7 mt -66.78 -35.52 80.28 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.067 0.46 . . . . 0.0 110.033 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.455 HG23 ' O ' ' A' ' 123' ' ' GLN . 5.3 p -82.97 -5.89 59.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.463 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.586 HD12 ' HA ' ' A' ' 125' ' ' LEU . 50.3 mt -92.84 -70.8 0.68 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.823 -179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.45 ' SG ' ' HD3' ' A' ' 130' ' ' PRO . 0.0 OUTLIER 47.19 -172.5 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.883 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.613 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 1.3 Cg_endo -80.11 141.5 14.74 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.755 1.637 . . . . 0.0 112.35 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.187 179.69 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.484 0.953 0 N-CA-C 111.179 -0.354 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 3.9 t -166.18 143.44 4.4 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.115 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 85.0 Cg_endo -97.31 -157.72 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.331 2.687 . . . . 0.0 111.917 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . 0.46 ' HB2' HG22 ' A' ' 121' ' ' THR . 3.3 pt-20 -81.24 75.63 8.2 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.599 0.714 . . . . 0.0 110.241 179.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.05 119.77 23.95 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.168 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.52 ' NE ' HG23 ' A' ' 121' ' ' THR . 17.3 mmt180 -77.54 120.2 22.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.245 -0.888 . . . . 0.0 111.118 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.784 ' HG3' HD21 ' B' ' 33' ' ' LEU . 10.3 pt-20 -133.1 143.86 49.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.321 0.582 . . . . 0.0 110.466 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 78.0 mttt -62.93 113.27 2.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.862 -1.063 . . . . 0.0 113.22 -177.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.784 HD21 ' HG3' ' B' ' 31' ' ' GLU . 6.7 mt -110.19 99.7 8.72 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.842 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.625 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.9 OUTLIER -99.03 95.32 7.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.298 0.57 . . . . 0.0 111.354 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.413 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 59.95 -82.42 0.01 OUTLIER Glycine 0 C--N 1.321 -0.254 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.18 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.472 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.0 t-160 -66.21 -51.64 55.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.273 0.536 . . . . 0.0 111.501 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.411 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -54.0 -39.7 66.3 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 176.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.748 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 22.4 t80 -64.39 -28.91 70.01 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 112.692 -2.049 . . . . 0.0 109.597 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.545 ' O ' HG21 ' B' ' 43' ' ' VAL . 2.2 t -72.58 -69.74 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.8 OUTLIER -41.06 -57.57 2.0 Allowed 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 123.382 0.426 . . . . 0.0 111.258 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.472 ' O ' ' CG2' ' B' ' 45' ' ' VAL . . . -55.44 -50.24 70.33 Favored 'General case' 0 C--O 1.21 -0.987 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.408 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.69 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -46.5 -35.91 6.18 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.271 0.558 . . . . 0.0 110.749 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.598 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.5 OUTLIER -77.51 -61.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.849 178.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 3.6 mmm180 -37.29 -40.37 0.34 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 122.622 1.201 . . . . 0.0 109.493 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.761 HG21 ' HA ' ' A' ' 122' ' ' GLN . 47.4 t -79.31 -71.22 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 112.607 -2.088 . . . . 0.0 114.108 -178.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 5.6 t -101.44 -26.01 13.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.789 -176.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.582 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 84.02 13.49 74.47 Favored Glycine 0 C--N 1.318 -0.449 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -178.302 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.613 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . 27.24 -133.97 0.03 OUTLIER Glycine 0 C--N 1.34 0.775 0 O-C-N 124.413 0.713 . . . . 0.0 113.094 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.56 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 60.5 Cg_endo -70.6 -144.13 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.512 2.141 . . . . 0.0 110.345 178.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.494 ' HE ' ' HB2' ' B' ' 52' ' ' SER . 6.8 ptm180 -89.68 -28.92 19.12 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.598 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 45.5 m95 63.2 10.04 4.35 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' SER . . . . . 0.494 ' HB2' ' HE ' ' B' ' 50' ' ' ARG . 51.1 m -89.89 -10.45 45.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.009 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 55.2 p -81.38 90.1 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.131 0.491 . . . . 0.0 111.027 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 46.78 86.38 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.195 -0.912 . . . . 0.0 111.37 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.156 -0.926 . . . . 0.0 111.056 -179.837 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.824 0.345 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -164.69 35.69 0.07 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.157 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.411 ' O ' HG21 ' A' ' 109' ' ' THR . . . -105.4 28.75 7.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.179 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.411 HG21 ' O ' ' A' ' 108' ' ' ALA . 6.1 t 40.74 58.54 2.4 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.271 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.448 ' HB2' ' HB2' ' A' ' 113' ' ' ARG . 2.5 m-20 47.61 94.36 0.05 OUTLIER Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.44 -178.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -59.16 -4.62 2.32 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.092 1.861 . . . . 0.0 112.237 -179.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.413 ' H ' ' C ' ' A' ' 110' ' ' ASN . . . -98.96 -41.14 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.211 0.529 . . . . 0.0 110.581 179.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.448 ' HB2' ' HB2' ' A' ' 110' ' ' ASN . 27.4 mmt180 -77.59 -36.62 51.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.833 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.463 ' CZ ' ' SG ' ' A' ' 120' ' ' CYS . 0.0 OUTLIER -65.54 -36.92 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.365 -179.494 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.544 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 13.5 m -83.15 -22.85 33.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.21 178.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.593 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 40.6 t -61.35 -54.04 48.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.315 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.5 mt -79.3 -32.51 43.53 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 70.7 m -105.5 -61.61 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.409 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 121.13 154.12 9.19 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 -178.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 124' ' ' ASP . 92.1 m -133.78 139.58 46.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.455 HG21 ' HG2' ' B' ' 30' ' ' ARG . 43.2 p -73.99 160.36 31.43 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.868 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.716 ' HA ' HG21 ' B' ' 45' ' ' VAL . 18.5 mt-30 -57.61 -16.98 12.01 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.436 ' HB2' ' OG1' ' A' ' 121' ' ' THR . 6.3 mt-30 -70.55 -52.11 23.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.572 ' HB3' ' HB3' ' A' ' 120' ' ' CYS . 7.9 t70 -54.0 -54.36 40.11 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.504 ' HB3' ' HA ' ' B' ' 42' ' ' LEU . 1.1 mt -58.82 -31.14 68.2 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.776 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.6 mt -64.79 -27.6 69.0 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 109.895 178.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -91.45 -16.46 27.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.291 -179.821 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 17.1 mt -95.91 -4.61 43.2 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.339 0.59 . . . . 0.0 109.865 -179.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.561 ' N ' ' CD ' ' A' ' 130' ' ' PRO . 15.8 t -58.7 -44.89 99.53 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.65 179.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 129' ' ' CYS . 72.5 Cg_endo -87.0 12.07 3.08 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.726 2.951 . . . . 0.0 112.771 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.188 -0.91 . . . . 0.0 110.836 179.864 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.482 0.848 0 N-CA-C 111.181 -0.353 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.434 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 1.4 p -161.27 143.46 9.07 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.802 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 88.1 Cg_endo -97.97 58.68 0.08 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 123.286 2.657 . . . . 0.0 111.897 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 37.68 69.61 0.23 Allowed 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.049 -178.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.8 tpt -75.83 116.07 16.16 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.427 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.455 ' HG2' HG21 ' A' ' 121' ' ' THR . 8.7 mtt180 -75.29 165.74 24.71 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.965 -178.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 6.4 tp10 -169.73 140.73 2.18 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.36 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.8 103.63 1.16 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.301 -179.168 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.74 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 26.9 mt -98.67 97.1 8.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.713 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.593 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.2 m -95.48 78.13 3.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.297 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.43 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.05 -80.49 0.19 Allowed Glycine 0 C--O 1.228 -0.23 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.541 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.46 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 9.2 t-160 -60.3 -55.89 28.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 117.083 0.441 . . . . 0.0 110.696 179.128 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.479 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 14.5 m-70 -51.83 -43.81 63.3 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.74 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.9 t80 -60.08 -27.99 67.44 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.993 -1.912 . . . . 0.0 110.067 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.528 ' O ' HG21 ' B' ' 43' ' ' VAL . 0.9 OUTLIER -73.11 -62.46 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.307 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.6 OUTLIER -48.27 -64.14 0.88 Allowed 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.704 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.476 ' HB2' HD22 ' A' ' 125' ' ' LEU . . . -47.16 -44.06 21.56 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.105 -0.638 . . . . 0.0 109.782 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -50.49 -45.22 56.27 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-O 121.451 0.643 . . . . 0.0 110.137 179.622 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.653 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -72.85 -60.62 2.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.129 179.055 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.418 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.6 mtt180 -34.66 -41.6 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 122.264 1.03 . . . . 0.0 109.123 177.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.716 HG21 ' HA ' ' A' ' 122' ' ' GLN . 70.6 t -72.44 -61.1 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.84 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . 0.442 ' HB3' ' HB2' ' A' ' 129' ' ' CYS . 34.8 t -138.8 -61.02 0.58 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.679 -176.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.567 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 167.51 -117.41 0.73 Allowed Glycine 0 N--CA 1.445 -0.704 0 CA-C-N 114.736 -1.12 . . . . 0.0 112.485 -178.182 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.574 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 162.4 -134.19 3.38 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.198 -179.35 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.492 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 91.0 Cg_endo -78.41 41.56 1.07 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.944 2.429 . . . . 0.0 112.331 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.412 ' C ' ' CD1' ' B' ' 51' ' ' TRP . 2.6 mmp_? 69.39 -30.13 0.19 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.252 0.621 . . . . 0.0 112.504 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.653 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 9.3 m95 64.11 -71.19 0.07 Allowed 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.097 0.475 . . . . 0.0 111.967 179.042 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 73.9 m -145.68 -104.9 0.1 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.533 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 58.2 p 40.63 73.8 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.469 0.652 . . . . 0.0 111.737 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -84.08 24.69 0.9 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.131 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.033 -179.985 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.862 0.363 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -151.09 -20.36 0.21 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.296 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -110.62 105.96 15.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.381 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.412 ' OG1' ' N ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER 33.6 -94.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.211 179.787 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.412 ' N ' ' OG1' ' A' ' 109' ' ' THR . 15.8 m120 -152.51 93.15 3.34 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.586 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 55.8 Cg_endo -65.81 -8.25 19.09 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.44 2.094 . . . . 0.0 113.075 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.27 -41.3 11.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.244 0.545 . . . . 0.0 110.606 179.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -79.77 -49.89 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.792 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.586 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -53.84 -31.63 50.08 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.965 -179.11 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.607 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 65.0 m -81.53 -34.35 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.446 -0.501 . . . . 0.0 111.828 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.624 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 48.0 t -56.18 -34.64 66.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 98.6 mt -81.6 -55.66 4.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.281 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.456 ' HG ' ' H ' ' A' ' 119' ' ' GLY . 16.0 p -104.7 -53.32 2.71 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.994 -179.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.607 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 118.62 162.87 12.31 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.913 -0.661 . . . . 0.0 111.926 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . 0.724 ' SG ' HD11 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -117.4 157.28 26.47 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.545 0.688 . . . . 0.0 111.878 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.578 ' C ' ' H ' ' A' ' 123' ' ' GLN . 58.3 p -93.69 159.64 15.12 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.526 178.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.727 ' HA ' HG23 ' B' ' 45' ' ' VAL . 26.3 mt-30 -65.37 6.1 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.578 ' H ' ' C ' ' A' ' 121' ' ' THR . 56.8 mt-30 -98.26 -53.65 3.29 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 175.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.524 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 3.4 m-20 -56.73 -53.98 51.54 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.653 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.2 mt -56.2 -32.54 64.47 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.901 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.483 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.3 mt -67.29 -37.59 83.66 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 123' ' ' GLN . 7.0 p -79.17 -5.9 55.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' A' ' 125' ' ' LEU . 71.0 mt -91.24 -74.79 0.49 Allowed 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.565 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' CYS . . . . . 0.503 ' N ' HD23 ' B' ' 42' ' ' LEU . 0.1 OUTLIER 46.28 -174.67 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 179.973 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.475 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 13.6 Cg_exo -71.08 -9.12 25.0 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.811 1.674 . . . . 0.0 112.106 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.965 -179.8 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo . . . . . 0 N--CA 1.485 1.017 0 N-CA-C 111.028 -0.412 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.2 p -161.07 126.81 2.3 Favored Pre-proline 0 CA--C 1.531 0.216 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.012 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -99.44 -156.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.564 2.843 . . . . 0.0 111.534 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -80.98 77.56 7.87 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 121.512 0.672 . . . . 0.0 109.833 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 6.6 ttp -78.66 114.64 17.76 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.197 -179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' ARG . . . . . 0.417 ' HG2' HG21 ' A' ' 121' ' ' THR . 8.3 mtt180 -78.37 172.29 13.83 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.3 -1.318 . . . . 0.0 112.042 -178.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.9 tp10 -170.94 131.37 0.82 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.604 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 70.2 mttt -63.75 110.4 2.04 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.739 -178.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.766 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 25.6 mt -107.82 108.36 19.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.403 -1.271 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' CYS . . . . . 0.624 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -102.1 77.84 1.72 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.396 0.617 . . . . 0.0 111.06 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 71.17 -79.9 0.5 Allowed Glycine 0 C--N 1.318 -0.47 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.994 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.487 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 6.1 t-160 -64.37 -51.95 60.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 117.43 0.615 . . . . 0.0 110.981 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' HIS . . . . . 0.471 ' HB3' HD22 ' B' ' 33' ' ' LEU . 10.8 m170 -54.58 -37.06 65.07 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.766 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.1 t80 -64.9 -27.99 69.23 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 113.095 -1.866 . . . . 0.0 109.736 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.53 ' O ' HG21 ' B' ' 43' ' ' VAL . 1.7 t -73.63 -64.71 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.487 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.1 mpt_? -44.26 -59.88 2.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 123.37 0.419 . . . . 0.0 111.456 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.569 ' HB2' HD13 ' B' ' 33' ' ' LEU . . . -54.09 -46.18 71.99 Favored 'General case' 0 C--O 1.21 -0.974 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -47.87 -37.9 15.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.479 0.657 . . . . 0.0 110.076 -179.888 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' VAL . . . . . 0.589 HG13 ' HA2' ' B' ' 47' ' ' GLY . 0.6 OUTLIER -75.32 -60.45 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.071 178.902 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' ARG . . . . . 0.515 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.6 mtt180 -39.1 -37.54 0.39 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.333 1.063 . . . . 0.0 109.323 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.727 HG23 ' HA ' ' A' ' 122' ' ' GLN . 59.2 t -79.31 -70.78 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 113.223 -1.808 . . . . 0.0 113.894 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.0 t -99.92 -29.74 12.4 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.773 -176.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.589 ' HA2' HG13 ' B' ' 43' ' ' VAL . . . 91.82 11.79 59.97 Favored Glycine 0 C--N 1.318 -0.437 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.603 -178.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . 0.48 ' CA ' ' HE1' ' B' ' 51' ' ' TRP . . . 39.1 -141.89 0.49 Allowed Glycine 0 CA--C 1.52 0.359 0 O-C-N 123.717 0.304 . . . . 0.0 113.73 179.294 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.591 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 59.9 Cg_endo -71.3 -68.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.071 2.514 . . . . 0.0 114.025 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' ARG . . . . . 0.449 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 82.1 mtm180 -156.29 -41.11 0.08 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.579 -178.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' TRP . . . . . 0.591 ' CE2' ' HD2' ' B' ' 49' ' ' PRO . 14.5 m95 60.8 8.42 1.81 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.993 179.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' SER . . . . . 0.463 ' O ' ' N ' ' B' ' 54' ' ' GLU . 70.0 m -64.99 -67.13 0.46 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.698 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 67.9 p 53.88 -77.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.934 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' B' ' 52' ' ' SER . 40.2 mt-10 -81.08 9.7 6.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.746 0.308 . . . . 0.0 110.888 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.236 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.46 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.52 -0.179 0 CA-C-O 121.164 0.507 . . . . 0.0 110.999 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -77.62 -48.77 16.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.855 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.465 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.91 -46.41 71.44 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.138 -179.468 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -74.55 -24.44 58.94 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.802 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.55 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.9 t -63.14 -40.55 97.9 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.787 0.327 . . . . 0.0 110.999 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.4 mt -80.9 -45.0 17.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.821 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 32.5 t -108.31 -53.89 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.462 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 126.03 167.86 12.54 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.621 -179.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.783 ' HB2' HD12 ' B' ' 33' ' ' LEU . 68.1 m -140.64 138.73 34.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.799 ' O ' HD12 ' A' ' 125' ' ' LEU . 82.0 p -81.24 160.2 24.34 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.376 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.908 ' HG2' HG22 ' B' ' 45' ' ' VAL . 50.1 mt-30 -54.31 -17.64 3.18 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.635 ' O ' HG23 ' A' ' 127' ' ' THR . 44.9 mt-30 -71.27 -55.92 7.08 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.598 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -53.01 -56.01 19.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.866 -0.791 . . . . 0.0 108.866 178.435 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mp -57.95 -32.18 67.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.028 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 126' ' ' LEU . 7.0 mt -63.99 -28.3 69.71 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 120.837 0.351 . . . . 0.0 110.24 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.635 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -102.0 -2.6 29.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.722 -179.618 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 59.0 mt . . . . . 0 N--CA 1.45 -0.475 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.379 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.435 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.6 pt-20 . . . . . 0 CA--C 1.512 -0.511 0 CA-C-O 121.499 0.666 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -62.6 107.09 0.88 Allowed 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.676 -177.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.783 HD12 ' HB2' ' A' ' 120' ' ' CYS . 24.6 mt -97.59 95.74 7.82 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.692 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.55 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 33.9 m -92.31 85.96 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.576 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.88 -78.41 0.01 OUTLIER Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.776 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.498 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 1.8 t60 -63.5 -54.18 40.41 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 117.074 0.437 . . . . 0.0 111.161 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 12.0 m-70 -52.37 -42.84 64.31 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 176.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.744 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 35.1 t80 -62.84 -28.81 70.28 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 112.579 -2.1 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.617 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.5 t -71.85 -66.9 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.538 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.9 OUTLIER -46.15 -59.12 3.08 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 119.374 -0.346 . . . . 0.0 110.641 178.844 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.821 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.3 -49.5 61.16 Favored 'General case' 0 C--O 1.213 -0.864 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.249 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.682 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.47 -38.62 4.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.381 0.61 . . . . 0.0 110.035 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -78.05 -65.7 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.332 179.345 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 44' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 6.1 mtt180 -32.87 -42.42 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 122.473 1.13 . . . . 0.0 109.94 177.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.908 HG22 ' HG2' ' A' ' 122' ' ' GLN . 58.8 t -74.67 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.105 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.3 t . . . . . 0 CA--C 1.514 -0.436 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.631 -176.179 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.41 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.248 0.547 . . . . 0.0 109.905 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.46 -24.3 56.95 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.491 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.472 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -62.89 -58.16 8.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.184 179.185 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.633 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -71.85 -29.61 64.57 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.437 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.637 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -57.45 -34.86 69.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.006 0.431 . . . . 0.0 110.479 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.9 mt -79.58 -59.67 2.65 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.891 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.3 m -105.14 -39.45 6.2 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 113.0 157.59 12.87 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.418 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.449 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.1 m -127.69 148.12 50.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.26 0.553 . . . . 0.0 112.424 -179.128 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.833 ' O ' HD12 ' A' ' 125' ' ' LEU . 12.5 p -84.76 165.7 17.59 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.334 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.868 ' HG2' HG22 ' B' ' 45' ' ' VAL . 11.1 mt-30 -65.27 0.09 1.56 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.408 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.609 ' O ' HG23 ' A' ' 127' ' ' THR . 93.6 mt-30 -92.06 -53.49 4.23 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.207 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.593 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.64 -54.22 46.83 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.374 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.833 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -57.47 -33.19 67.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.487 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.438 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.5 mt -62.85 -28.31 69.94 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.996 0.427 . . . . 0.0 110.205 178.437 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.609 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -98.07 -4.29 36.23 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.382 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 50.8 mt . . . . . 0 N--CA 1.449 -0.491 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.626 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.564 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.2 pt-20 . . . . . 0 CA--C 1.515 -0.387 0 CA-C-O 121.167 0.508 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -60.06 112.03 1.73 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.961 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.781 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.8 mt -106.14 99.05 8.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.528 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.637 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -100.23 96.73 7.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.137 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.49 -83.16 0.01 OUTLIER Glycine 0 C--N 1.321 -0.285 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.966 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.451 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.4 t-160 -64.43 -54.14 37.25 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.241 0.52 . . . . 0.0 111.475 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.445 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.5 m-70 -53.59 -39.06 64.55 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.781 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.5 t80 -65.47 -27.94 68.86 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 112.916 -1.947 . . . . 0.0 109.77 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.643 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.6 t -74.22 -68.01 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.388 -0.824 . . . . 0.0 108.847 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.568 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.4 OUTLIER -43.79 -57.83 3.04 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 123.25 0.344 . . . . 0.0 111.086 179.379 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.831 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.78 -51.82 59.13 Favored 'General case' 0 C--O 1.212 -0.893 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.301 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.637 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.33 -39.64 3.21 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.279 0.561 . . . . 0.0 110.476 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.643 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -76.22 -64.57 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.073 179.29 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -34.45 -41.84 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.523 1.154 . . . . 0.0 110.051 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.868 HG22 ' HG2' ' A' ' 122' ' ' GLN . 68.3 t -73.78 -65.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 112.768 -2.014 . . . . 0.0 113.38 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 11.2 t . . . . . 0 CA--C 1.514 -0.436 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.603 -176.419 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.223 0 CA-C-O 121.076 0.465 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 25.5 ttt180 -77.86 -51.6 10.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.183 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.49 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -51.91 -35.94 47.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.719 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 74.3 m -79.0 -30.67 44.4 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 112.04 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.646 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.5 t -56.89 -45.46 82.57 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.574 -0.451 . . . . 0.0 110.006 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 19.5 mt -81.03 -38.94 26.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.316 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.5 t -106.66 -72.7 0.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.719 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.36 156.79 8.97 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.825 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -113.24 159.68 19.08 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.709 0.766 . . . . 0.0 112.233 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.703 ' O ' HD12 ' A' ' 125' ' ' LEU . 64.0 p -95.78 155.29 16.81 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.293 178.081 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.903 ' HG2' HG22 ' B' ' 45' ' ' VAL . 20.5 mt-30 -60.25 -3.28 0.59 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.726 ' O ' HG23 ' A' ' 127' ' ' THR . 47.6 mt-30 -87.86 -56.37 3.37 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.595 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.8 t70 -53.1 -54.33 37.15 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.186 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.2 mt -56.94 -35.01 68.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.321 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.471 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.0 mt -64.07 -25.54 68.15 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-O 120.822 0.344 . . . . 0.0 110.162 178.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.726 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.2 p -97.14 -6.76 34.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.483 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.75 HD12 ' HA ' ' A' ' 125' ' ' LEU . 29.0 mt . . . . . 0 N--CA 1.452 -0.348 0 CA-C-O 120.886 0.374 . . . . 0.0 110.536 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.464 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.8 pt-20 . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 121.628 0.728 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.99 112.4 2.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.183 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.829 HD13 ' HA ' ' B' ' 38' ' ' PHE . 31.4 mt -112.74 107.29 15.88 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.695 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.646 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -101.84 81.12 2.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.53 0.681 . . . . 0.0 111.206 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 65.09 -81.97 0.07 OUTLIER Glycine 0 C--N 1.321 -0.294 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.932 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -58.0 -56.08 26.61 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 117.315 0.558 . . . . 0.0 110.871 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -52.59 -46.53 66.97 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.829 ' HA ' HD13 ' B' ' 33' ' ' LEU . 24.7 t80 -54.26 -31.01 52.53 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.187 -1.824 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.703 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.2 t -72.83 -52.49 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.533 ' NE ' HG12 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -51.53 -65.04 0.63 Allowed 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.61 0.569 . . . . 0.0 110.912 179.421 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.879 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.32 -45.88 55.09 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -47.05 -40.89 15.82 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.255 0.55 . . . . 0.0 109.813 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.703 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.6 OUTLIER -73.48 -65.13 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.029 178.342 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -34.0 -41.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.086 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.903 HG22 ' HG2' ' A' ' 122' ' ' GLN . 78.5 t -74.5 -60.37 2.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 113.417 -1.72 . . . . 0.0 112.447 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.2 t . . . . . 0 CA--C 1.514 -0.437 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.68 -176.313 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.46 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.518 -0.255 0 CA-C-O 121.367 0.604 . . . . 0.0 109.713 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -77.18 -24.95 51.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.194 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.483 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -63.83 -54.91 27.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.473 179.382 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.578 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.7 m -74.82 -14.13 60.65 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.586 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.612 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.0 t -76.91 -28.16 55.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.032 0.444 . . . . 0.0 110.075 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.0 mt -81.11 -34.44 32.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.699 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 m -138.33 -36.09 0.59 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.417 ' CA ' ' HA ' ' B' ' 32' ' ' LYS . . . 118.36 171.74 15.34 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.763 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.659 ' HB2' HD12 ' B' ' 33' ' ' LEU . 71.2 m -140.58 138.38 34.41 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.287 0.565 . . . . 0.0 112.463 -179.379 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.711 ' O ' HD12 ' A' ' 125' ' ' LEU . 74.2 p -77.25 157.88 30.58 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.501 179.167 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.886 ' HG2' HG22 ' B' ' 45' ' ' VAL . 15.8 mt-30 -53.57 -20.63 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.614 ' O ' HG23 ' A' ' 127' ' ' THR . 97.2 mt-30 -70.53 -54.02 13.82 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.591 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -53.94 -53.03 58.45 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 178.258 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.722 HD21 HD13 ' B' ' 33' ' ' LEU . 1.1 mt -61.12 -30.72 70.54 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.629 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 7.0 mt -63.44 -27.17 69.1 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.614 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.5 OUTLIER -92.38 -16.0 26.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.902 179.759 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 14.5 mt . . . . . 0 N--CA 1.446 -0.638 0 CA-C-O 121.561 0.696 . . . . 0.0 109.267 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.409 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.8 pt-20 . . . . . 0 CA--C 1.514 -0.417 0 CA-C-O 121.42 0.628 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.417 ' HA ' ' CA ' ' A' ' 119' ' ' GLY . 13.9 mtpt -63.16 108.2 1.21 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.625 -178.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.788 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 9.7 mt -101.91 98.86 9.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.959 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.612 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.7 t -99.83 94.09 6.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.251 0.548 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.11 -83.4 0.02 OUTLIER Glycine 0 C--N 1.321 -0.264 0 CA-C-N 115.029 -0.987 . . . . 0.0 112.991 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -60.19 -57.3 13.38 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.91 0.355 . . . . 0.0 111.493 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 8.2 m170 -52.96 -44.73 67.35 Favored 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.788 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 20.2 t80 -57.7 -28.99 64.32 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.897 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.585 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.0 OUTLIER -74.15 -60.22 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.145 177.815 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.542 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.5 OUTLIER -49.43 -64.34 0.84 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 119.414 -0.327 . . . . 0.0 110.632 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.882 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -46.05 -49.23 16.55 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.498 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.625 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.56 -41.0 6.16 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.322 0.582 . . . . 0.0 110.431 179.883 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.585 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -79.84 -59.74 2.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.489 179.595 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 44' ' ' ARG . . . . . 0.435 ' HE ' ' HB3' ' B' ' 40' ' ' ARG . 4.8 mtt180 -36.22 -39.37 0.18 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.104 0.954 . . . . 0.0 109.335 177.261 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.886 HG22 ' HG2' ' A' ' 122' ' ' GLN . 59.8 t -76.02 -53.17 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 113.538 -1.664 . . . . 0.0 111.387 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 45.6 t . . . . . 0 N--CA 1.45 -0.433 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.271 -177.004 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.449 0 CA-C-O 121.682 0.753 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.07 -34.34 59.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.335 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.43 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -62.19 -29.26 70.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.334 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.715 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 60.3 m -84.01 -33.91 24.42 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.813 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.596 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.6 t -54.9 -35.5 64.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 44.2 mt -82.4 -53.72 5.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.47 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 58.3 m -106.91 -58.46 1.93 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.715 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 128.64 174.22 13.67 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.372 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.999 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -133.13 155.17 49.77 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.376 0.588 . . . . 0.0 111.701 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.69 ' O ' HD12 ' A' ' 125' ' ' LEU . 67.8 p -97.71 159.94 14.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.524 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.815 ' HG2' HG22 ' B' ' 45' ' ' VAL . 16.3 mt-30 -62.13 2.67 0.22 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.632 ' O ' HG23 ' A' ' 127' ' ' THR . 50.3 mt-30 -94.92 -57.01 2.56 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.495 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 2.7 m-20 -55.41 -51.0 68.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mt -59.04 -34.73 72.25 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.097 179.002 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.481 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.4 mt -63.24 -30.35 71.51 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.745 0.307 . . . . 0.0 110.796 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.632 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -94.43 -5.46 46.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.519 -179.613 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.5 HD13 ' HZ ' ' B' ' 38' ' ' PHE . 95.5 mt . . . . . 0 N--CA 1.452 -0.342 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.799 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.494 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.9 pt-20 . . . . . 0 CA--C 1.515 -0.393 0 CA-C-O 121.526 0.679 . . . . 0.0 111.892 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 118' ' ' SER . 81.6 mttt -65.64 109.59 2.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.204 -1.362 . . . . 0.0 112.799 -177.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.999 HD12 ' SG ' ' A' ' 120' ' ' CYS . 58.7 mt -105.78 96.61 6.61 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.537 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.596 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.8 t -92.23 84.44 5.22 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.351 -179.099 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 63.11 -77.79 0.03 OUTLIER Glycine 0 C--N 1.32 -0.35 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.976 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.485 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 1.2 t60 -65.1 -52.46 55.3 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.32 0.56 . . . . 0.0 111.054 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.529 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 11.6 m170 -55.23 -35.32 64.81 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.774 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 47.0 t80 -69.5 -26.42 64.53 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 113.007 -1.906 . . . . 0.0 109.664 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.648 ' O ' HG23 ' B' ' 43' ' ' VAL . 2.3 t -73.71 -68.33 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 176.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.526 ' N ' HG12 ' B' ' 39' ' ' VAL . 2.4 mpt_? -43.76 -55.11 4.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.525 0.516 . . . . 0.0 110.942 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.925 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -56.12 -49.35 74.15 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.084 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -45.45 -40.88 8.8 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.469 0.652 . . . . 0.0 110.104 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.648 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -71.18 -62.02 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.907 178.903 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 44' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 4.9 mtt180 -38.68 -38.33 0.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.337 1.065 . . . . 0.0 109.759 177.398 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.925 HG23 ' O ' ' B' ' 41' ' ' ALA . 58.5 t -76.18 -63.38 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 113.072 -1.877 . . . . 0.0 114.024 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 CA--C 1.514 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.54 -176.01 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.464 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.517 -0.305 0 CA-C-O 121.403 0.62 . . . . 0.0 109.617 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.65 -26.0 50.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.474 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.452 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -63.16 -56.24 18.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.571 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.629 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -72.98 -29.17 62.85 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.791 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.637 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.5 t -57.44 -37.58 73.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.729 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 14.3 mt -79.58 -56.44 4.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.833 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.9 m -105.27 -43.16 5.07 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.418 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 115.01 160.67 12.92 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.386 -178.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.43 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.9 m -131.21 148.17 52.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.307 0.575 . . . . 0.0 112.534 -179.251 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.829 ' O ' HD12 ' A' ' 125' ' ' LEU . 12.3 p -85.44 164.47 17.86 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.038 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.895 ' HG2' HG22 ' B' ' 45' ' ' VAL . 40.8 mt-30 -63.11 -3.68 1.9 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.213 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.632 ' O ' HG23 ' A' ' 127' ' ' THR . 8.7 mm100 -87.87 -54.28 4.32 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.6 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.49 -54.07 48.47 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.389 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.829 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -57.46 -32.8 67.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.533 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.479 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.8 mt -64.13 -27.99 69.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.852 0.358 . . . . 0.0 110.11 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.632 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -94.9 -7.35 40.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.232 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.623 HD12 ' HA ' ' A' ' 125' ' ' LEU . 34.5 mt . . . . . 0 N--CA 1.449 -0.48 0 CA-C-O 120.759 0.314 . . . . 0.0 110.521 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.56 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.1 pt-20 . . . . . 0 CA--C 1.516 -0.344 0 CA-C-O 121.211 0.529 . . . . 0.0 110.201 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -62.73 112.58 2.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.923 -177.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.793 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 4.8 mt -106.42 99.68 9.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.421 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.637 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -99.98 98.74 9.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.395 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 56.66 -83.27 0.01 OUTLIER Glycine 0 C--N 1.322 -0.242 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.057 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.446 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.3 t-160 -63.4 -55.14 26.78 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 117.281 0.541 . . . . 0.0 111.439 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -53.06 -42.84 66.21 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.793 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 19.7 t80 -60.09 -30.58 69.34 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.001 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.651 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.4 t -72.76 -64.2 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.604 ' HE ' HG12 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -42.71 -62.63 0.95 Allowed 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 123.617 0.573 . . . . 0.0 110.634 179.065 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.846 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.0 -52.72 40.0 Favored 'General case' 0 C--O 1.21 -0.975 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.233 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.79 -38.81 3.43 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.042 0.448 . . . . 0.0 110.439 -179.88 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.651 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -76.98 -64.4 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.055 179.058 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 -33.83 -43.56 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.468 1.128 . . . . 0.0 110.136 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.895 HG22 ' HG2' ' A' ' 122' ' ' GLN . 57.3 t -72.47 -58.86 4.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 112.799 -2.001 . . . . 0.0 112.676 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.5 t . . . . . 0 C--N 1.325 -0.46 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.508 -176.181 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.469 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 121.237 0.541 . . . . 0.0 110.417 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -21.35 52.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.566 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.447 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -71.02 -51.29 26.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.983 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.587 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.4 m -74.56 -19.09 60.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.113 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.64 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.3 t -71.12 -48.58 51.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.786 0.326 . . . . 0.0 111.164 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.1 mt -80.85 -15.08 57.3 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 47.8 t -134.44 -52.73 0.82 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.494 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 115.69 147.78 9.12 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.448 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.628 ' HB2' HD12 ' B' ' 33' ' ' LEU . 95.4 m -122.67 140.7 52.56 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.733 ' O ' HD12 ' A' ' 125' ' ' LEU . 75.3 p -76.72 155.51 33.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.756 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.891 ' HG2' HG22 ' B' ' 45' ' ' VAL . 20.2 mt-30 -55.15 -20.25 9.75 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.57 ' O ' HG23 ' A' ' 127' ' ' THR . 6.9 mp0 -69.84 -51.83 30.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.622 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -54.63 -57.11 12.72 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.019 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.741 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -56.21 -30.75 62.75 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.64 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.2 mt -62.88 -31.71 72.81 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.069 0.461 . . . . 0.0 109.847 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.57 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -100.54 -1.44 35.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.707 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 72.7 mt . . . . . 0 N--CA 1.45 -0.442 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.129 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.557 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.3 tp10 . . . . . 0 CA--C 1.51 -0.577 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 60.4 mttt -68.14 101.99 1.26 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.431 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.77 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.5 mt -99.91 98.44 9.22 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.42 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.9 t -98.71 94.57 6.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.167 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.49 -80.6 0.01 OUTLIER Glycine 0 C--N 1.32 -0.357 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.901 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 3.5 t-160 -65.98 -55.24 17.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.184 0.492 . . . . 0.0 111.494 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.459 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -53.14 -36.85 61.28 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 177.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.77 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.9 t80 -67.72 -29.22 68.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 112.988 -1.914 . . . . 0.0 109.822 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.558 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.5 t -73.11 -65.61 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.387 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.52 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.9 OUTLIER -48.34 -58.6 4.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 119.204 -0.426 . . . . 0.0 110.934 179.221 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.8 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.53 -47.07 57.69 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.519 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.628 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.17 -39.24 13.35 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.205 0.526 . . . . 0.0 110.275 179.582 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.558 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -79.76 -62.48 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.382 179.697 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 44' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mtt180 -32.25 -40.8 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.437 1.113 . . . . 0.0 108.866 176.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.891 HG22 ' HG2' ' A' ' 122' ' ' GLN . 91.2 t -74.93 -66.43 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 112.949 -1.932 . . . . 0.0 112.215 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 47.7 t . . . . . 0 CA--C 1.513 -0.455 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.057 -175.848 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.156 0 CA-C-O 121.292 0.568 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -77.49 -52.3 9.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.334 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.428 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -54.8 -31.59 59.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.732 -178.824 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.725 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 68.1 m -79.92 -22.18 43.03 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.956 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.627 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.8 t -70.6 -33.94 71.6 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.4 mt -84.12 -24.72 30.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.155 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.474 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 78.1 p -136.58 -63.04 0.64 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.753 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.725 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.21 156.11 8.76 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.761 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.968 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -107.96 155.85 19.87 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 121.666 0.746 . . . . 0.0 112.213 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 125' ' ' LEU . 32.7 p -94.84 151.27 19.37 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.441 178.246 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.919 ' HG2' HG22 ' B' ' 45' ' ' VAL . 24.2 mt-30 -56.56 -8.07 0.5 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.611 ' O ' HG23 ' A' ' 127' ' ' THR . 18.7 mm-40 -83.46 -54.96 4.58 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.554 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 1.7 t70 -54.27 -54.71 36.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.674 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -56.67 -34.01 66.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.442 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.9 mt -62.89 -29.57 70.87 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.919 0.39 . . . . 0.0 110.572 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -99.75 -2.08 36.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.386 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.572 HD12 ' HA ' ' A' ' 125' ' ' LEU . 72.0 mt . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 120.727 0.299 . . . . 0.0 110.694 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.63 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 4.7 tp10 . . . . . 0 CA--C 1.512 -0.509 0 CA-C-O 121.234 0.54 . . . . 0.0 111.265 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 118' ' ' SER . 4.0 mtpm? -63.24 100.02 0.21 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.62 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.968 HD12 ' SG ' ' A' ' 120' ' ' CYS . 63.4 mt -100.24 102.25 13.48 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.826 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.627 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.1 t -98.14 76.86 2.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.361 0.6 . . . . 0.0 111.223 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.27 -75.61 0.5 Allowed Glycine 0 C--N 1.319 -0.373 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.857 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.46 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 5.2 t-160 -66.63 -53.17 37.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.496 0.648 . . . . 0.0 110.841 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.5 m170 -53.7 -38.17 63.99 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.802 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 37.8 t80 -64.75 -30.25 71.26 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.037 -1.892 . . . . 0.0 109.835 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.599 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.5 t -71.09 -66.32 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.562 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -46.26 -61.35 1.82 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 119.38 -0.343 . . . . 0.0 110.408 178.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.863 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -48.35 -50.14 31.61 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.513 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.679 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -45.16 -41.56 8.21 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.3 0.571 . . . . 0.0 110.067 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.599 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -74.81 -64.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.191 179.165 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 44' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 5.5 mtt180 -33.28 -41.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 122.289 1.042 . . . . 0.0 109.86 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.919 HG22 ' HG2' ' A' ' 122' ' ' GLN . 59.3 t -74.05 -58.54 4.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 113.277 -1.783 . . . . 0.0 112.561 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 46' ' ' CYS . . . . . 0.426 ' HB2' ' HA ' ' A' ' 126' ' ' LEU . 22.2 t . . . . . 0 CA--C 1.515 -0.382 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.277 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.315 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.84 -18.8 53.43 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.951 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.438 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -72.55 -56.25 5.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.857 -179.585 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.612 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -74.35 -21.73 59.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.904 0.383 . . . . 0.0 110.923 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.653 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.7 t -68.99 -47.85 64.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.9 0.381 . . . . 0.0 110.903 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.2 mt -81.8 -17.5 47.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.287 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 t -132.21 -54.79 0.97 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.565 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 116.95 149.21 9.02 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.509 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.465 ' HB2' HD12 ' B' ' 33' ' ' LEU . 78.0 m -127.22 146.28 50.47 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.225 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.808 ' O ' HD12 ' A' ' 125' ' ' LEU . 65.9 p -87.23 165.06 15.97 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.833 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.842 ' HG2' HG22 ' B' ' 45' ' ' VAL . 14.3 mt-30 -61.68 -0.59 0.46 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 177.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.665 ' O ' HG23 ' A' ' 127' ' ' THR . 79.7 mt-30 -89.85 -54.37 4.08 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 176.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.53 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -57.99 -50.12 74.5 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.808 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mp -60.48 -31.72 70.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.24 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.452 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.2 mt -64.55 -28.43 69.64 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 120.961 0.41 . . . . 0.0 110.007 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -95.58 -5.57 42.3 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.501 -179.795 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 44.5 mt . . . . . 0 N--CA 1.449 -0.477 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.175 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.631 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.2 tp10 . . . . . 0 CA--C 1.51 -0.589 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 57.6 mttt -65.92 102.42 0.78 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.565 0.698 . . . . 0.0 112.133 -178.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.769 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.0 mt -103.94 100.38 10.16 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.581 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.653 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -99.9 92.28 5.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.88 -80.25 0.02 OUTLIER Glycine 0 C--N 1.322 -0.235 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.889 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.498 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 4.1 t-160 -65.19 -55.66 17.32 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 117.337 0.568 . . . . 0.0 111.182 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.455 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.7 m-70 -52.95 -37.53 61.15 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.769 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 25.4 t80 -67.14 -27.94 67.72 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.02 -1.9 . . . . 0.0 109.786 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.589 HG12 ' N ' ' B' ' 40' ' ' ARG . 1.0 OUTLIER -74.46 -65.77 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.226 177.496 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.589 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -46.01 -57.97 3.97 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 119.385 -0.341 . . . . 0.0 110.848 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.882 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.0 -51.74 55.26 Favored 'General case' 0 C--O 1.212 -0.914 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.975 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.641 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -42.45 -38.06 1.79 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.281 0.562 . . . . 0.0 110.473 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.589 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.3 OUTLIER -77.31 -64.78 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.1 179.073 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 44' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 5.0 mtt180 -34.21 -40.8 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 122.464 1.126 . . . . 0.0 109.767 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.882 HG23 ' O ' ' B' ' 41' ' ' ALA . 60.8 t -74.51 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.778 -179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.0 t . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.538 -176.307 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 121.448 0.642 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.6 mmm180 -78.51 -23.86 46.1 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.911 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.462 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -70.08 -51.21 33.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.773 179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.571 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 4.5 m -75.49 -16.03 60.35 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.679 -0.409 . . . . 0.0 110.957 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.643 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.9 t -71.57 -53.02 15.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.857 0.361 . . . . 0.0 111.272 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.8 mt -79.84 -13.94 59.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.338 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.7 t -129.29 -55.63 1.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.462 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 114.4 144.11 8.5 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.565 ' HB2' HD12 ' B' ' 33' ' ' LEU . 89.8 m -122.03 142.59 50.17 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.53 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.748 ' O ' HD12 ' A' ' 125' ' ' LEU . 73.3 p -75.81 157.05 33.88 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.648 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.731 ' HG2' HG22 ' B' ' 45' ' ' VAL . 21.7 mt-30 -58.83 -14.46 8.92 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.224 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.627 ' O ' HG23 ' A' ' 127' ' ' THR . 71.0 mt-30 -74.31 -51.96 13.65 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.628 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.4 OUTLIER -52.66 -57.39 10.22 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.977 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.756 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -54.36 -34.43 61.14 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.488 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.459 HD23 ' HB2' ' B' ' 46' ' ' CYS . 6.3 mt -60.76 -32.94 72.22 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.184 0.516 . . . . 0.0 110.001 178.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.627 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -90.94 -9.46 46.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.631 -179.565 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 27.5 mt . . . . . 0 N--CA 1.45 -0.456 0 CA-C-O 120.965 0.412 . . . . 0.0 110.069 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 5.5 tp10 . . . . . 0 CA--C 1.511 -0.528 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -67.42 101.84 1.03 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.387 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.718 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.2 mt -97.26 96.68 8.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.324 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.643 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -97.66 88.7 4.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.049 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.553 ' O ' HG23 ' B' ' 39' ' ' VAL . . . 64.22 -78.23 0.05 OUTLIER Glycine 0 C--N 1.318 -0.426 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.639 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.541 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 0.6 OUTLIER -66.37 -54.42 24.7 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 117.336 0.568 . . . . 0.0 111.659 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.493 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 6.8 m-70 -54.51 -34.26 61.35 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.718 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 27.3 t80 -71.68 -27.04 62.78 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.167 -1.833 . . . . 0.0 109.654 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.561 ' O ' HG23 ' B' ' 43' ' ' VAL . 2.3 t -73.61 -62.53 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.615 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.441 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.2 OUTLIER -60.72 -42.48 97.35 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.022 179.272 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.748 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -61.03 -40.85 95.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.438 1.017 . . . . 0.0 109.225 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.612 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.6 -47.02 67.21 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.125 0.488 . . . . 0.0 111.28 179.834 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.1 OUTLIER -76.09 -49.24 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.174 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 44' ' ' ARG . . . . . 0.439 ' HD3' ' C ' ' B' ' 44' ' ' ARG . 0.0 OUTLIER -43.91 -40.58 4.67 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-O 122.864 1.316 . . . . 0.0 107.764 177.874 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.756 HG21 ' HB2' ' A' ' 125' ' ' LEU . 56.0 t -74.05 -62.66 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.195 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 46' ' ' CYS . . . . . 0.459 ' HB2' HD23 ' A' ' 126' ' ' LEU . 49.1 t . . . . . 0 N--CA 1.451 -0.422 0 CA-C-N 113.917 -1.492 . . . . 0.0 111.927 -176.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.456 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.52 -0.184 0 CA-C-O 121.254 0.549 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.448 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.7 OUTLIER -78.3 -35.15 48.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.879 178.901 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.489 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -59.97 -56.66 18.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.135 179.842 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.572 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 9.3 m -69.38 -16.41 63.51 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.287 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.628 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -71.34 -46.72 59.9 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.599 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 9.0 mt -80.58 -16.59 53.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 80.5 p -133.68 -51.48 0.85 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.401 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 117.98 160.85 11.75 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.521 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 92.1 m -136.89 143.46 43.0 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.766 ' O ' HD12 ' A' ' 125' ' ' LEU . 82.3 p -80.82 161.29 24.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.554 179.245 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.922 ' HG2' HG22 ' B' ' 45' ' ' VAL . 27.8 mt-30 -58.28 -15.17 9.17 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.654 ' O ' HG23 ' A' ' 127' ' ' THR . 93.2 mt-30 -73.77 -54.68 7.49 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.602 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -54.45 -55.33 29.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.848 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.766 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mp -58.83 -31.08 68.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.965 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 6.8 mt -64.77 -27.6 69.01 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.866 0.365 . . . . 0.0 110.158 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -97.94 -6.52 32.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.266 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 40.7 mt . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.748 0.309 . . . . 0.0 110.702 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.578 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.0 tp10 . . . . . 0 CA--C 1.513 -0.461 0 CA-C-O 120.994 0.426 . . . . 0.0 110.399 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -64.65 102.54 0.58 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.793 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.772 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 34.2 mt -99.58 104.88 16.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.14 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.628 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.6 OUTLIER -103.26 95.31 6.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.447 0.641 . . . . 0.0 111.124 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 58.97 -87.66 0.02 OUTLIER Glycine 0 C--O 1.227 -0.299 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.17 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.497 ' O ' ' HG3' ' B' ' 40' ' ' ARG . 2.3 t60 -59.02 -56.63 19.8 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 117.206 0.503 . . . . 0.0 111.597 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -48.74 -48.78 40.38 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.772 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 22.6 t80 -55.94 -31.28 62.8 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 112.994 -1.912 . . . . 0.0 110.424 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.704 ' O ' HG23 ' B' ' 43' ' ' VAL . 0.5 OUTLIER -72.79 -45.04 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.787 178.189 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' B' ' 36' ' ' HIS . 1.9 mtt180 -61.09 -61.03 2.87 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.879 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.825 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.68 -45.56 66.88 Favored 'General case' 0 C--O 1.208 -1.098 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -45.84 -38.65 7.53 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.349 0.595 . . . . 0.0 109.724 179.433 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.4 OUTLIER -76.72 -63.41 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.4 178.79 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtm180 -36.7 -40.62 0.27 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.439 1.114 . . . . 0.0 110.195 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.922 HG22 ' HG2' ' A' ' 122' ' ' GLN . 99.4 t -75.19 -65.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 112.949 -1.932 . . . . 0.0 113.4 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.613 -176.053 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 120.948 0.404 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.5 OUTLIER -76.89 -40.5 47.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.654 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.458 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -59.83 -34.82 73.58 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.811 -179.39 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.783 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 73.5 m -77.5 -21.05 53.35 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.071 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.603 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.3 t -65.41 -43.4 90.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 20.9 mt -84.29 -20.71 31.69 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.215 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.514 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 43.2 t -127.53 -75.86 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 111.364 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.783 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 132.76 155.03 7.73 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.124 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.983 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -114.48 149.75 35.87 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.538 0.685 . . . . 0.0 112.273 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.702 ' O ' HD12 ' A' ' 125' ' ' LEU . 39.0 p -87.89 150.86 23.24 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.051 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.901 ' HG2' HG22 ' B' ' 45' ' ' VAL . 24.3 mt-30 -53.06 -19.22 2.58 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.525 ' O ' HG23 ' A' ' 127' ' ' THR . 0.0 OUTLIER -72.55 -53.61 11.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.503 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 6.0 t70 -55.1 -52.18 64.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.83 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.1 mt -59.01 -31.9 69.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.856 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.532 ' HG ' HG13 ' B' ' 45' ' ' VAL . 7.7 mt -63.3 -28.94 70.36 Favored 'General case' 0 C--O 1.231 0.095 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.052 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -98.09 -3.89 36.97 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.376 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.83 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.1 mt . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 120.759 0.314 . . . . 0.0 110.444 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.514 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.3 pt-20 . . . . . 0 CA--C 1.511 -0.555 0 CA-C-O 121.62 0.724 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 118' ' ' SER . 79.8 mttt -60.19 104.94 0.36 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.288 -1.324 . . . . 0.0 112.604 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.983 HD12 ' SG ' ' A' ' 120' ' ' CYS . 63.9 mt -101.33 98.79 9.12 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.186 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.603 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.3 t -94.9 78.32 3.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.388 0.613 . . . . 0.0 111.19 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 67.43 -75.15 0.2 Allowed Glycine 0 C--N 1.32 -0.319 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.744 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.508 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 1.1 t60 -65.81 -52.23 52.35 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 117.237 0.519 . . . . 0.0 110.912 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.528 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.8 m170 -55.44 -36.99 67.11 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 176.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.791 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 39.4 t80 -67.21 -27.3 67.14 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 112.987 -1.915 . . . . 0.0 109.683 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.546 HG12 ' N ' ' B' ' 40' ' ' ARG . 1.6 t -73.13 -66.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-N 115.118 -0.947 . . . . 0.0 108.811 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.546 ' N ' HG12 ' B' ' 39' ' ' VAL . 2.5 mpt_? -48.65 -59.64 3.37 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 119.267 -0.396 . . . . 0.0 110.461 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.845 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -48.45 -43.81 34.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.805 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.663 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.94 -42.85 65.84 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 121.033 0.444 . . . . 0.0 110.332 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.52 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -74.45 -59.5 3.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.128 179.214 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 44' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mmm180 -33.56 -40.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.437 1.113 . . . . 0.0 108.504 176.462 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.901 HG22 ' HG2' ' A' ' 122' ' ' GLN . 75.0 t -75.84 -65.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 112.997 -1.91 . . . . 0.0 111.751 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 31.8 t . . . . . 0 N--CA 1.449 -0.49 0 CA-C-N 114.225 -1.352 . . . . 0.0 111.671 -176.398 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.425 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.516 -0.353 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.06 -16.46 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.979 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.409 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -73.25 -46.1 52.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.599 179.643 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.588 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.2 m -83.06 -20.64 34.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.391 . . . . 0.0 110.825 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.661 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.4 t -69.72 -50.31 44.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.6 mt -80.95 -14.88 57.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.024 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 27.2 t -131.91 -59.23 0.95 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.584 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.3 147.48 7.89 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 -178.448 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.578 ' HB2' HD12 ' B' ' 33' ' ' LEU . 94.4 m -123.06 145.0 48.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.803 ' O ' HD12 ' A' ' 125' ' ' LEU . 39.9 p -82.21 157.91 23.77 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.742 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.922 ' HG2' HG22 ' B' ' 45' ' ' VAL . 43.8 mt-30 -56.85 -18.61 13.67 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.69 ' O ' HG23 ' A' ' 127' ' ' THR . 47.2 mt-30 -72.15 -52.07 18.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.577 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.3 OUTLIER -54.62 -57.01 13.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.471 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.803 HD12 ' O ' ' A' ' 121' ' ' THR . 1.3 mp -59.26 -28.87 67.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.144 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.431 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 7.1 mt -66.79 -27.01 67.23 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.857 0.36 . . . . 0.0 110.084 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -100.95 -3.73 28.96 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.354 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.678 HD12 ' HA ' ' A' ' 125' ' ' LEU . 28.2 mt . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.854 0.359 . . . . 0.0 110.369 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.2 tp10 . . . . . 0 CA--C 1.509 -0.621 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 12.7 mtpt -69.86 102.74 2.02 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.688 0.756 . . . . 0.0 111.612 -178.77 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.765 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.2 mt -100.91 101.59 12.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.386 -1.279 . . . . 0.0 111.743 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.661 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -98.6 91.25 5.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.305 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.72 -79.5 0.01 OUTLIER Glycine 0 C--N 1.321 -0.258 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.914 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.477 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 3.4 t-160 -63.6 -54.94 28.08 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.106 0.453 . . . . 0.0 111.191 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.403 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 4.5 m-70 -54.96 -38.31 67.6 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.217 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.765 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 26.5 t80 -65.25 -26.99 68.34 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.062 -1.881 . . . . 0.0 109.626 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.64 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.4 t -74.38 -65.11 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.561 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.1 OUTLIER -43.69 -62.37 1.12 Allowed 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 123.259 0.349 . . . . 0.0 110.721 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.762 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.54 -50.85 52.27 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 119.807 -0.757 . . . . 0.0 109.032 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.669 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -42.39 -38.93 2.02 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.374 0.607 . . . . 0.0 110.267 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.64 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.3 OUTLIER -78.59 -67.58 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.272 178.964 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 44' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 10.0 mtt180 -32.26 -42.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 122.396 1.093 . . . . 0.0 110.35 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.922 HG22 ' HG2' ' A' ' 122' ' ' GLN . 92.5 t -73.04 -59.87 2.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 113.106 -1.861 . . . . 0.0 112.924 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 13.5 t . . . . . 0 CA--C 1.513 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.137 -176.202 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.397 0.618 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -79.83 -54.11 6.14 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.409 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.461 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -50.61 -32.06 17.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.144 -179.489 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.665 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 72.7 m -85.42 -34.66 21.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.568 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.591 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.0 t -51.11 -36.43 40.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.223 0.535 . . . . 0.0 109.602 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 75.6 mt -81.41 -59.0 2.79 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.245 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.8 m -101.59 -57.03 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.836 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.665 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 124.39 163.14 11.61 Favored Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.624 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.768 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -111.86 167.98 9.94 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.453 0.644 . . . . 0.0 111.432 179.802 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.699 ' O ' HD12 ' A' ' 125' ' ' LEU . 42.3 p -103.44 155.28 18.62 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 114.755 -1.111 . . . . 0.0 109.496 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.886 ' HG2' HG22 ' B' ' 45' ' ' VAL . 31.2 mt-30 -58.84 -5.75 0.66 Allowed 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.562 ' O ' HG23 ' A' ' 127' ' ' THR . 2.5 mp0 -88.42 -51.78 5.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.599 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t70 -55.01 -56.2 22.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.752 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.1 mt -56.01 -32.05 63.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.714 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 5.8 mt -62.7 -30.59 71.51 Favored 'General case' 0 CA--C 1.524 -0.053 0 CA-C-O 121.028 0.442 . . . . 0.0 110.191 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.562 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -96.42 -5.25 40.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.559 -179.725 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.9 mt . . . . . 0 N--CA 1.45 -0.428 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.992 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 10.9 pt-20 . . . . . 0 CA--C 1.514 -0.439 0 CA-C-O 121.592 0.71 . . . . 0.0 110.936 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 82.0 mttt -55.54 117.5 3.64 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.322 -1.308 . . . . 0.0 112.478 -178.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.809 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 21.4 mt -116.93 100.91 8.08 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.183 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.591 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 83.2 m -95.79 76.78 3.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.27 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.34 -81.98 0.2 Allowed Glycine 0 C--O 1.229 -0.193 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.842 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.563 ' O ' ' HG3' ' B' ' 40' ' ' ARG . 11.3 t-160 -60.27 -53.41 57.99 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 117.285 0.542 . . . . 0.0 110.725 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.597 ' HA ' ' HE ' ' B' ' 40' ' ' ARG . 13.1 m-70 -52.58 -45.13 66.33 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.809 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 24.2 t80 -56.03 -29.36 60.3 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 113.104 -1.862 . . . . 0.0 109.85 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.704 ' O ' HG23 ' B' ' 43' ' ' VAL . 0.9 OUTLIER -73.09 -57.63 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.387 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.597 ' HE ' ' HA ' ' B' ' 37' ' ' HIS . 23.9 mtm180 -44.92 -66.7 0.36 Allowed 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.159 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.892 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.08 -46.5 61.8 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.669 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.82 -39.11 17.43 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.265 0.555 . . . . 0.0 109.792 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.7 OUTLIER -73.22 -65.03 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.95 178.238 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -34.94 -41.04 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.165 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.892 HG23 ' O ' ' B' ' 41' ' ' ALA . 66.5 t -74.46 -61.86 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 113.34 -1.755 . . . . 0.0 112.89 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.515 -0.391 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.368 -176.285 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.098 0.475 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -77.1 -48.41 17.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.926 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.442 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -55.22 -30.58 60.27 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.095 -179.248 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.673 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 70.7 m -84.01 -29.0 27.3 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.19 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.601 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 51.4 t -54.94 -42.73 72.67 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.407 ' O ' ' HE2' ' B' ' 32' ' ' LYS . 12.0 mt -81.51 -46.48 14.43 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.926 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.0 m -102.92 -74.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.1 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.673 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 135.1 156.93 7.84 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.589 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.946 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -108.46 168.07 9.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.522 0.677 . . . . 0.0 111.765 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.754 ' O ' HD12 ' A' ' 125' ' ' LEU . 26.9 p -107.69 158.67 17.08 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.696 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.848 ' HG2' HG22 ' B' ' 45' ' ' VAL . 30.4 mt-30 -62.57 -2.38 1.07 Allowed 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.001 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.717 ' O ' HG23 ' A' ' 127' ' ' THR . 97.0 mt-30 -90.65 -57.07 2.95 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 176.06 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.537 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.5 OUTLIER -54.44 -53.39 54.82 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.304 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.754 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mt -56.05 -36.37 67.96 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.789 178.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' B' ' 46' ' ' CYS . 5.6 mt -62.27 -31.06 71.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 120.974 0.416 . . . . 0.0 109.942 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.717 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -90.19 -7.72 52.91 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.47 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.604 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.4 mt . . . . . 0 N--CA 1.449 -0.477 0 CA-C-O 121.148 0.499 . . . . 0.0 109.984 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.0 pt-20 . . . . . 0 CA--C 1.509 -0.613 0 CA-C-O 121.515 0.674 . . . . 0.0 110.846 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 4.6 mtpm? -60.4 106.58 0.55 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.394 -1.276 . . . . 0.0 112.421 -177.618 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.946 HD12 ' SG ' ' A' ' 120' ' ' CYS . 60.1 mt -106.14 98.19 7.91 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.945 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.601 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.6 m -93.22 71.05 4.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.214 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.7 -75.18 0.57 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.443 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.549 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 7.8 t-160 -64.27 -51.35 63.98 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 117.133 0.466 . . . . 0.0 110.569 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.574 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 13.2 m-70 -56.13 -39.18 71.85 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.783 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 38.4 t80 -63.46 -26.4 68.71 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.216 179.113 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.606 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.6 t -74.57 -67.28 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.79 176.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.582 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.7 OUTLIER -45.37 -58.47 3.3 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.207 0.317 . . . . 0.0 110.51 178.898 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.929 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.1 -51.86 39.5 Favored 'General case' 0 C--O 1.214 -0.81 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.58 -44.67 8.98 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.313 0.578 . . . . 0.0 110.465 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.606 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -69.34 -62.65 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.898 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -35.56 -39.83 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.849 -1.068 . . . . 0.0 109.684 177.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.929 HG23 ' O ' ' B' ' 41' ' ' ALA . 57.3 t -74.13 -58.19 5.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.904 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 46' ' ' CYS . . . . . 0.608 ' HB2' HD23 ' A' ' 126' ' ' LEU . 39.5 t . . . . . 0 CA--C 1.512 -0.498 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.853 -177.167 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 120.944 0.402 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.9 mmt180 -77.38 -45.29 26.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.954 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.13 -28.49 64.72 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.956 -179.16 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.737 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 98.7 m -84.68 -24.09 29.12 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.9 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.646 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.6 t -60.57 -45.18 94.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.96 -40.84 23.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.498 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.8 t -101.68 -78.45 0.53 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.391 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.737 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.2 147.35 6.32 Favored Glycine 0 C--O 1.228 -0.261 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.732 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 1.023 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -109.85 142.4 41.2 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.081 0.467 . . . . 0.0 110.86 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.7 p -72.01 -91.12 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 122.333 1.063 . . . . 0.0 111.453 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.894 ' HG2' HG22 ' B' ' 45' ' ' VAL . 24.3 mt-30 -156.28 -30.64 0.09 Allowed 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.986 -1.915 . . . . 0.0 108.546 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.691 ' O ' HG23 ' A' ' 127' ' ' THR . 49.3 mt-30 -63.66 -49.08 74.61 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.16 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.55 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 31.5 t70 -57.05 -56.46 21.44 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.643 HD21 HD13 ' B' ' 33' ' ' LEU . 1.1 mt -58.3 -25.33 61.73 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.76 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.44 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 11.2 mt -71.77 -30.87 66.04 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.874 0.369 . . . . 0.0 110.338 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -92.1 -7.28 49.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.232 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 24.1 mt . . . . . 0 N--CA 1.449 -0.498 0 CA-C-O 120.763 0.316 . . . . 0.0 110.919 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.61 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 10.1 tp10 . . . . . 0 CA--C 1.51 -0.563 0 CA-C-O 121.303 0.573 . . . . 0.0 111.713 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 76.7 mttt -63.27 102.23 0.38 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.912 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 1.023 HD12 ' SG ' ' A' ' 120' ' ' CYS . 60.4 mt -101.16 102.37 13.28 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.911 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.646 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.3 t -97.84 76.0 2.42 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.412 0.625 . . . . 0.0 111.355 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.435 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.35 -73.91 0.56 Allowed Glycine 0 C--N 1.319 -0.416 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.678 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.486 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 1.1 t60 -67.73 -52.86 32.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 117.142 0.471 . . . . 0.0 111.002 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.526 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.7 m170 -54.58 -36.22 64.15 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 176.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.785 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 41.7 t80 -66.67 -29.62 69.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 112.96 -1.927 . . . . 0.0 109.517 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.6 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.9 t -71.88 -68.25 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.305 -0.861 . . . . 0.0 108.694 177.312 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.573 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -45.53 -56.7 4.81 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 119.523 -0.275 . . . . 0.0 110.316 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.87 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.31 -51.61 52.72 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.078 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.65 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.14 -46.53 5.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.413 0.625 . . . . 0.0 110.303 179.852 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.6 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -68.76 -64.71 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.179 179.101 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -34.08 -41.64 0.11 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.249 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.894 HG22 ' HG2' ' A' ' 122' ' ' GLN . 71.5 t -74.26 -60.22 2.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 113.304 -1.771 . . . . 0.0 112.682 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.522 -176.188 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.416 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.517 -0.318 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 2.3 mpp_? -77.29 -20.96 54.29 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.405 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -65.4 -41.68 93.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.981 179.028 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.6 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 2.2 m -92.72 -22.65 19.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.09 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.603 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.1 t -65.02 -36.26 83.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.913 0.387 . . . . 0.0 110.516 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.68 -46.34 15.73 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.856 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 31.7 m -117.37 -44.64 2.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.501 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 119.84 163.72 12.34 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.557 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.617 ' HB2' HD12 ' B' ' 33' ' ' LEU . 81.9 m -134.08 139.04 45.7 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.354 0.597 . . . . 0.0 112.321 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.763 ' O ' HD12 ' A' ' 125' ' ' LEU . 58.8 p -75.41 154.01 37.37 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.695 179.29 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.759 ' HG2' HG22 ' B' ' 45' ' ' VAL . 13.4 mt-30 -53.38 -19.9 3.95 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.592 ' O ' HG23 ' A' ' 127' ' ' THR . 6.8 mm100 -68.98 -52.77 25.48 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.539 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.24 -54.01 48.79 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.392 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.763 HD12 ' O ' ' A' ' 121' ' ' THR . 1.4 mp -59.55 -29.87 68.22 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.451 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.562 ' HG ' HG13 ' B' ' 45' ' ' VAL . 7.5 mt -64.04 -29.97 71.07 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 178.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -101.36 -0.28 35.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.408 -179.882 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.667 HD12 ' HA ' ' A' ' 125' ' ' LEU . 52.0 mt . . . . . 0 N--CA 1.451 -0.414 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.667 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.459 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.6 pt-20 . . . . . 0 CA--C 1.515 -0.4 0 CA-C-O 121.104 0.478 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -61.31 108.15 0.88 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.179 -0.919 . . . . 0.0 113.168 -177.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.753 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.3 mt -103.87 96.8 6.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.896 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.603 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 5.0 t -96.27 90.56 5.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.36 0.6 . . . . 0.0 111.254 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.428 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.71 -78.71 0.02 OUTLIER Glycine 0 C--N 1.321 -0.255 0 CA-C-N 114.849 -1.069 . . . . 0.0 112.973 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.479 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 3.5 t-160 -66.06 -52.62 47.29 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.449 0.624 . . . . 0.0 111.215 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.475 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 4.4 m-70 -55.82 -35.64 66.57 Favored 'General case' 0 CA--C 1.501 -0.906 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 177.067 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.753 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 28.2 t80 -68.86 -26.73 65.29 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 112.962 -1.926 . . . . 0.0 109.433 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.585 HG12 ' N ' ' B' ' 40' ' ' ARG . 1.4 t -74.17 -67.12 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.852 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.585 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.6 mpt_? -44.74 -61.6 1.52 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.627 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.791 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -49.43 -45.76 46.86 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 119.861 -0.735 . . . . 0.0 109.548 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.644 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.3 OUTLIER -49.78 -41.16 43.65 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.065 0.46 . . . . 0.0 110.346 179.507 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.566 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -75.79 -61.67 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.292 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 44' ' ' ARG . . . . . 0.421 ' C ' ' O ' ' B' ' 43' ' ' VAL . 5.2 mtt180 -33.19 -41.48 0.07 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.547 1.165 . . . . 0.0 108.853 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.791 HG23 ' O ' ' B' ' 41' ' ' ALA . 82.5 t -74.99 -68.57 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-N 112.871 -1.968 . . . . 0.0 112.621 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 8.5 t . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.866 -175.99 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.404 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.486 0.66 . . . . 0.0 109.722 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -78.77 -26.24 44.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.182 178.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.485 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -70.54 -55.25 9.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.966 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.581 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 10.0 m -68.89 -24.4 64.32 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.242 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.626 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 38.0 t -61.3 -52.89 62.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.813 0.339 . . . . 0.0 111.15 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.0 mt -79.2 -34.72 42.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.056 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 m -106.4 -59.88 1.73 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.567 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.72 162.14 11.65 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.469 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.2 m -143.02 147.09 34.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.799 0.799 . . . . 0.0 112.882 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.829 ' O ' HD12 ' A' ' 125' ' ' LEU . 29.5 p -87.64 169.78 11.84 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.005 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.904 ' HG2' HG22 ' B' ' 45' ' ' VAL . 28.5 mt-30 -66.63 3.46 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.368 178.171 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.722 ' O ' HG23 ' A' ' 127' ' ' THR . 96.0 mt-30 -94.31 -54.83 3.4 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.57 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -56.33 -53.4 57.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.574 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.829 HD12 ' O ' ' A' ' 121' ' ' THR . 1.0 OUTLIER -56.75 -33.09 66.23 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.32 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.495 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.7 mt -66.78 -35.52 80.28 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.067 0.46 . . . . 0.0 110.033 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.722 HG23 ' O ' ' A' ' 123' ' ' GLN . 5.3 p -82.97 -5.89 59.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.463 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 125' ' ' LEU . 50.3 mt . . . . . 0 N--CA 1.446 -0.653 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.823 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.649 ' HG3' HD21 ' B' ' 33' ' ' LEU . 10.3 pt-20 . . . . . 0 CA--C 1.518 -0.268 0 CA-C-O 121.321 0.582 . . . . 0.0 110.466 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 78.0 mttt -62.93 113.27 2.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.862 -1.063 . . . . 0.0 113.22 -177.48 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.778 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 6.7 mt -110.19 99.7 8.72 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.842 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.626 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.9 OUTLIER -99.03 95.32 7.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.298 0.57 . . . . 0.0 111.354 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 59.95 -82.42 0.01 OUTLIER Glycine 0 C--N 1.321 -0.254 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.18 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.491 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.0 t-160 -66.21 -51.64 55.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.273 0.536 . . . . 0.0 111.501 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.427 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -54.0 -39.7 66.3 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 176.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.778 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 22.4 t80 -64.39 -28.91 70.01 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 112.692 -2.049 . . . . 0.0 109.597 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.668 ' O ' HG23 ' B' ' 43' ' ' VAL . 2.2 t -72.58 -69.74 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.546 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.8 OUTLIER -41.06 -57.57 2.0 Allowed 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 123.382 0.426 . . . . 0.0 111.258 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.871 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -55.44 -50.24 70.33 Favored 'General case' 0 C--O 1.21 -0.987 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.408 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.706 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -46.5 -35.91 6.18 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.271 0.558 . . . . 0.0 110.749 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.668 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.5 OUTLIER -77.51 -61.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.849 178.998 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 3.6 mmm180 -37.29 -40.37 0.34 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 122.622 1.201 . . . . 0.0 109.493 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.904 HG22 ' HG2' ' A' ' 122' ' ' GLN . 47.4 t -79.31 -71.22 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 112.607 -2.088 . . . . 0.0 114.108 -178.55 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.518 -0.252 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.789 -176.006 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 121.211 0.529 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -77.59 -36.62 51.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.833 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.463 ' CZ ' ' SG ' ' A' ' 120' ' ' CYS . 0.0 OUTLIER -65.54 -36.92 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.365 -179.494 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.568 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 13.5 m -83.15 -22.85 33.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.21 178.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.597 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 40.6 t -61.35 -54.04 48.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.315 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.5 mt -79.3 -32.51 43.53 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 70.7 m -105.5 -61.61 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.476 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 121.13 154.12 9.19 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 -178.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.608 ' HB3' ' HB3' ' A' ' 124' ' ' ASP . 92.1 m -133.78 139.58 46.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.779 ' O ' HD12 ' A' ' 125' ' ' LEU . 43.2 p -73.99 160.36 31.43 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.868 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.874 ' HG2' HG22 ' B' ' 45' ' ' VAL . 18.5 mt-30 -57.61 -16.98 12.01 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.644 ' O ' HG23 ' A' ' 127' ' ' THR . 6.3 mt-30 -70.55 -52.11 23.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.608 ' HB3' ' HB3' ' A' ' 120' ' ' CYS . 7.9 t70 -54.0 -54.36 40.11 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.808 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -58.82 -31.14 68.2 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.776 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.6 mt -64.79 -27.6 69.0 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 109.895 178.417 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.644 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -91.45 -16.46 27.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.291 -179.821 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 17.1 mt . . . . . 0 N--CA 1.449 -0.515 0 CA-C-O 121.339 0.59 . . . . 0.0 109.865 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.531 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 6.4 tp10 . . . . . 0 CA--C 1.51 -0.59 0 CA-C-O 121.266 0.555 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.8 103.63 1.16 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.301 -179.168 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.783 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 26.9 mt -98.67 97.1 8.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.713 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.597 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.2 m -95.48 78.13 3.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.297 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.05 -80.49 0.19 Allowed Glycine 0 C--O 1.228 -0.23 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.541 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.485 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 9.2 t-160 -60.3 -55.89 28.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 117.083 0.441 . . . . 0.0 110.696 179.128 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.54 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 14.5 m-70 -51.83 -43.81 63.3 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.173 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.783 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.9 t80 -60.08 -27.99 67.44 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.993 -1.912 . . . . 0.0 110.067 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.592 ' O ' HG23 ' B' ' 43' ' ' VAL . 0.9 OUTLIER -73.11 -62.46 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.307 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.566 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.6 OUTLIER -48.27 -64.14 0.88 Allowed 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.704 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.836 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -47.16 -44.06 21.56 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.105 -0.638 . . . . 0.0 109.782 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.638 ' N ' HD22 ' A' ' 125' ' ' LEU . 0.5 OUTLIER -50.49 -45.22 56.27 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-O 121.451 0.643 . . . . 0.0 110.137 179.622 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.592 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -72.85 -60.62 2.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.129 179.055 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.6 mtt180 -34.66 -41.6 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 122.264 1.03 . . . . 0.0 109.123 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.874 HG22 ' HG2' ' A' ' 122' ' ' GLN . 70.6 t -72.44 -61.1 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.84 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 34.8 t . . . . . 0 N--CA 1.447 -0.611 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.679 -176.417 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 121.244 0.545 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -79.77 -49.89 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.792 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.475 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -53.84 -31.63 50.08 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.965 -179.11 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.699 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 65.0 m -81.53 -34.35 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.446 -0.501 . . . . 0.0 111.828 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' CYS . . . . . 0.632 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 48.0 t -56.18 -34.64 66.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 98.6 mt -81.6 -55.66 4.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.281 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 16.0 p -104.7 -53.32 2.71 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.994 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLY . . . . . 0.699 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 118.62 162.87 12.31 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.913 -0.661 . . . . 0.0 111.926 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' CYS . . . . . 0.84 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -117.4 157.28 26.47 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.545 0.688 . . . . 0.0 111.878 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.636 ' O ' HD12 ' A' ' 125' ' ' LEU . 58.3 p -93.69 159.64 15.12 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.526 178.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.876 ' HG2' HG22 ' B' ' 45' ' ' VAL . 26.3 mt-30 -65.37 6.1 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.73 ' O ' HG23 ' A' ' 127' ' ' THR . 56.8 mt-30 -98.26 -53.65 3.29 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 175.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.544 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 3.4 m-20 -56.73 -53.98 51.54 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.727 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.2 mt -56.2 -32.54 64.47 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.901 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.498 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.3 mt -67.29 -37.59 83.66 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' THR . . . . . 0.73 HG23 ' O ' ' A' ' 123' ' ' GLN . 7.0 p -79.17 -5.9 55.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 125' ' ' LEU . 71.0 mt . . . . . 0 N--CA 1.448 -0.558 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.565 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.9 tp10 . . . . . 0 CA--C 1.514 -0.42 0 CA-C-O 121.299 0.571 . . . . 0.0 110.604 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 70.2 mttt -63.75 110.4 2.04 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.739 -178.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.84 HD12 ' SG ' ' A' ' 120' ' ' CYS . 25.6 mt -107.82 108.36 19.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.403 -1.271 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 34' ' ' CYS . . . . . 0.632 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -102.1 77.84 1.72 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.396 0.617 . . . . 0.0 111.06 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.494 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 71.17 -79.9 0.5 Allowed Glycine 0 C--N 1.318 -0.47 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.994 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.517 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 6.1 t-160 -64.37 -51.95 60.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 117.43 0.615 . . . . 0.0 110.981 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 37' ' ' HIS . . . . . 0.418 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.8 m170 -54.58 -37.06 65.07 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.807 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.1 t80 -64.9 -27.99 69.23 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 113.095 -1.866 . . . . 0.0 109.736 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.667 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.7 t -73.63 -64.71 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.517 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.1 mpt_? -44.26 -59.88 2.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 123.37 0.419 . . . . 0.0 111.456 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.924 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -54.09 -46.18 71.99 Favored 'General case' 0 C--O 1.21 -0.974 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.681 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -47.87 -37.9 15.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.479 0.657 . . . . 0.0 110.076 -179.888 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 43' ' ' VAL . . . . . 0.667 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.6 OUTLIER -75.32 -60.45 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.071 178.902 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 44' ' ' ARG . . . . . 0.485 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.6 mtt180 -39.1 -37.54 0.39 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.333 1.063 . . . . 0.0 109.323 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.924 HG23 ' O ' ' B' ' 41' ' ' ALA . 59.2 t -79.31 -70.78 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 113.223 -1.808 . . . . 0.0 113.894 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.0 t . . . . . 0 CA--C 1.518 -0.259 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.773 -176.271 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.822 0.344 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.43 170.28 9.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.946 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -129.35 -155.49 0.7 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.087 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.2 t -74.98 -157.27 0.06 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.844 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -80.99 106.31 5.33 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.566 ' HB2' ' CZ ' ' B' ' 38' ' ' PHE . 24.5 Cg_endo -58.17 -37.68 94.46 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.23 1.953 . . . . 0.0 113.034 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.46 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -58.13 -42.65 86.26 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.164 0.507 . . . . 0.0 110.999 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -77.62 -48.77 16.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.855 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.465 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.91 -46.41 71.44 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.138 -179.468 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -74.55 -24.44 58.94 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.802 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.55 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.9 t -63.14 -40.55 97.9 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.787 0.327 . . . . 0.0 110.999 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.4 mt -80.9 -45.0 17.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.821 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 32.5 t -108.31 -53.89 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.462 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 126.03 167.86 12.54 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.621 -179.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.783 ' HB2' HD12 ' B' ' 33' ' ' LEU . 68.1 m -140.64 138.73 34.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.842 HG23 ' HG3' ' B' ' 30' ' ' ARG . 82.0 p -81.24 160.2 24.34 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.376 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.908 ' HG2' HG22 ' B' ' 45' ' ' VAL . 50.1 mt-30 -54.31 -17.64 3.18 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.635 ' O ' HG23 ' A' ' 127' ' ' THR . 44.9 mt-30 -71.27 -55.92 7.08 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.598 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -53.01 -56.01 19.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.866 -0.791 . . . . 0.0 108.866 178.435 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mp -57.95 -32.18 67.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.028 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 126' ' ' LEU . 7.0 mt -63.99 -28.3 69.71 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 120.837 0.351 . . . . 0.0 110.24 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.635 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -102.0 -2.6 29.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.722 -179.618 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 59.0 mt -96.1 -16.74 21.38 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.379 -179.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 30.2 p -71.42 155.52 92.65 Favored Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.376 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.51 25.5 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.259 2.64 . . . . 0.0 112.727 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.951 179.816 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.483 0.907 0 N-CA-C 111.009 -0.42 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.424 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 59.1 p 54.34 119.23 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.017 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 87.0 Cg_endo -93.89 -157.33 0.05 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 122.976 2.45 . . . . 0.0 111.847 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.479 ' HB3' ' H ' ' A' ' 122' ' ' GLN . 3.2 pt-20 -81.08 77.21 8.0 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.733 0.778 . . . . 0.0 109.989 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 23.4 ttt -82.19 14.94 2.6 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.714 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.842 ' HG3' HG23 ' A' ' 121' ' ' THR . 0.1 OUTLIER 40.65 37.69 0.52 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.767 179.828 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.435 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.6 pt-20 -66.0 157.14 31.64 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.499 0.666 . . . . 0.0 110.934 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -62.6 107.09 0.88 Allowed 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.676 -177.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.783 HD12 ' HB2' ' A' ' 120' ' ' CYS . 24.6 mt -97.59 95.74 7.82 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.692 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.55 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 33.9 m -92.31 85.96 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.576 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.88 -78.41 0.01 OUTLIER Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.776 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.498 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 1.8 t60 -63.5 -54.18 40.41 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 117.074 0.437 . . . . 0.0 111.161 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 12.0 m-70 -52.37 -42.84 64.31 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 176.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.744 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 35.1 t80 -62.84 -28.81 70.28 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 112.579 -2.1 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.679 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.5 t -71.85 -66.9 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.538 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.9 OUTLIER -46.15 -59.12 3.08 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 119.374 -0.346 . . . . 0.0 110.641 178.844 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.821 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.3 -49.5 61.16 Favored 'General case' 0 C--O 1.213 -0.864 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.249 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.682 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.47 -38.62 4.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.381 0.61 . . . . 0.0 110.035 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.645 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -78.05 -65.7 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.332 179.345 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 6.1 mtt180 -32.87 -42.42 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 122.473 1.13 . . . . 0.0 109.94 177.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.908 HG22 ' HG2' ' A' ' 122' ' ' GLN . 58.8 t -74.67 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.105 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.3 t -119.44 -55.36 2.13 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.631 -176.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.55 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 146.26 -90.97 0.15 Allowed Glycine 0 C--N 1.317 -0.499 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.392 -178.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.541 ' CA ' ' HE1' ' B' ' 51' ' ' TRP . . . 134.54 -138.56 10.14 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.134 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.612 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 56.8 Cg_endo -70.75 -67.11 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.663 2.242 . . . . 0.0 113.003 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' B' ' 49' ' ' PRO . 82.5 mtm180 -157.44 -44.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.936 0.398 . . . . 0.0 111.49 -178.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.679 ' CH2' HG13 ' B' ' 39' ' ' VAL . 18.3 m95 63.01 -0.76 0.56 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.519 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' SER . . . . . 0.462 ' O ' ' N ' ' B' ' 54' ' ' GLU . 69.0 m -71.78 -74.98 0.14 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.752 0.311 . . . . 0.0 110.617 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 81.6 p 53.73 -77.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.212 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' GLU . . . . . 0.462 ' N ' ' O ' ' B' ' 52' ' ' SER . 34.8 tt0 -81.58 -11.67 59.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.124 0.488 . . . . 0.0 110.959 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.009 -179.981 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.811 0.339 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -155.1 -18.95 0.11 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.247 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -107.26 -165.49 1.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.215 0.531 . . . . 0.0 111.352 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 12.1 t -77.56 -159.67 0.15 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.811 178.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -82.76 105.38 4.87 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.57 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 30.5 Cg_endo -59.71 -4.21 2.53 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.43 2.087 . . . . 0.0 113.254 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.41 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -86.09 -54.37 4.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.248 0.547 . . . . 0.0 109.905 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.46 -24.3 56.95 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.491 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.57 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -62.89 -58.16 8.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.184 179.185 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.633 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -71.85 -29.61 64.57 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.437 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.637 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -57.45 -34.86 69.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.006 0.431 . . . . 0.0 110.479 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.9 mt -79.58 -59.67 2.65 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.891 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.3 m -105.14 -39.45 6.2 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 113.0 157.59 12.87 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.418 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.449 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.1 m -127.69 148.12 50.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.26 0.553 . . . . 0.0 112.424 -179.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.833 ' O ' HD12 ' A' ' 125' ' ' LEU . 12.5 p -84.76 165.7 17.59 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.334 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.868 ' HG2' HG22 ' B' ' 45' ' ' VAL . 11.1 mt-30 -65.27 0.09 1.56 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.408 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.609 ' O ' HG23 ' A' ' 127' ' ' THR . 93.6 mt-30 -92.06 -53.49 4.23 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.207 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.593 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.64 -54.22 46.83 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.374 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.833 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -57.47 -33.19 67.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.487 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.438 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.5 mt -62.85 -28.31 69.94 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.996 0.427 . . . . 0.0 110.205 178.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.609 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -98.07 -4.29 36.23 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.382 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 50.8 mt -93.97 -18.18 22.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.626 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.401 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 29.4 p -69.38 154.93 94.43 Favored Pre-proline 0 CA--C 1.53 0.191 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.399 178.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -85.25 -1.18 9.2 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.139 2.559 . . . . 0.0 112.511 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.974 179.977 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.484 0.917 0 N-CA-C 111.157 -0.363 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.412 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 32.9 p -74.12 140.57 76.92 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.052 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 69.5 Cg_endo -94.01 69.7 0.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.034 2.489 . . . . 0.0 112.031 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 35.85 65.32 0.43 Allowed 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.78 0.8 . . . . 0.0 111.515 -178.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 5.6 ttp -77.93 111.65 14.01 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.527 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -78.35 123.93 27.54 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.832 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.564 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.2 pt-20 -142.03 142.18 32.87 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.195 179.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -60.06 112.03 1.73 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.961 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.781 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.8 mt -106.14 99.05 8.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.528 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.637 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -100.23 96.73 7.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.137 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.49 -83.16 0.01 OUTLIER Glycine 0 C--N 1.321 -0.285 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.966 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.451 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.4 t-160 -64.43 -54.14 37.25 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.241 0.52 . . . . 0.0 111.475 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.445 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.5 m-70 -53.59 -39.06 64.55 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.781 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.5 t80 -65.47 -27.94 68.86 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 112.916 -1.947 . . . . 0.0 109.77 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.681 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.6 t -74.22 -68.01 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.388 -0.824 . . . . 0.0 108.847 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.568 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.4 OUTLIER -43.79 -57.83 3.04 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 123.25 0.344 . . . . 0.0 111.086 179.379 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.831 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.78 -51.82 59.13 Favored 'General case' 0 C--O 1.212 -0.893 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.301 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.637 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.33 -39.64 3.21 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.279 0.561 . . . . 0.0 110.476 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.643 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -76.22 -64.57 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.073 179.29 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -34.45 -41.84 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.523 1.154 . . . . 0.0 110.051 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.868 HG22 ' HG2' ' A' ' 122' ' ' GLN . 68.3 t -73.78 -65.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 112.768 -2.014 . . . . 0.0 113.38 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 11.2 t -111.66 -42.24 3.88 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.603 -176.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.422 ' O ' ' C ' ' B' ' 48' ' ' GLY . . . 108.36 10.39 25.68 Favored Glycine 0 C--N 1.317 -0.483 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.932 -178.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' B' ' 47' ' ' GLY . . . 29.41 -134.01 0.07 OUTLIER Glycine 0 C--N 1.336 0.572 0 O-C-N 124.031 0.489 . . . . 0.0 113.298 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.526 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 59.1 Cg_endo -68.67 -135.09 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 122.709 2.273 . . . . 0.0 112.473 179.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -81.61 -55.64 4.53 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -178.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.681 ' CH2' HG13 ' B' ' 39' ' ' VAL . 38.5 m95 67.2 10.57 7.81 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.194 -177.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 74.2 m 60.45 175.67 0.1 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.971 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 23.3 p -154.65 -47.52 0.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.176 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -157.04 72.92 0.73 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.997 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.292 -0.861 . . . . 0.0 111.057 -179.924 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.853 0.359 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -155.38 21.78 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.207 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.15 -161.89 0.84 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.078 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.474 HG23 ' N ' ' A' ' 110' ' ' ASN . 14.1 t -75.66 -149.4 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.936 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.474 ' N ' HG23 ' A' ' 109' ' ' THR . 17.4 m120 -80.67 107.85 8.41 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.522 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 56.5 Cg_endo -66.07 -7.04 15.89 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.266 1.977 . . . . 0.0 112.297 -179.105 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.01 -42.25 9.54 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.998 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 25.5 ttt180 -77.86 -51.6 10.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.183 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.522 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -51.91 -35.94 47.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.719 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 74.3 m -79.0 -30.67 44.4 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 112.04 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.646 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.5 t -56.89 -45.46 82.57 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.574 -0.451 . . . . 0.0 110.006 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 19.5 mt -81.03 -38.94 26.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.316 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.5 t -106.66 -72.7 0.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.719 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.36 156.79 8.97 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.825 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -113.24 159.68 19.08 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.709 0.766 . . . . 0.0 112.233 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.703 ' O ' HD12 ' A' ' 125' ' ' LEU . 64.0 p -95.78 155.29 16.81 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.293 178.081 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.903 ' HG2' HG22 ' B' ' 45' ' ' VAL . 20.5 mt-30 -60.25 -3.28 0.59 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.726 ' O ' HG23 ' A' ' 127' ' ' THR . 57.5 mt-30 -87.86 -56.37 3.37 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.595 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.8 t70 -53.1 -54.33 37.15 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.2 mt -56.94 -35.01 68.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.321 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.471 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.0 mt -64.07 -25.54 68.15 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-O 120.822 0.344 . . . . 0.0 110.162 178.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.726 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.2 p -97.14 -6.76 34.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.483 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.75 HD12 ' HA ' ' A' ' 125' ' ' LEU . 29.0 mt -91.78 -21.85 20.47 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.886 0.374 . . . . 0.0 110.536 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 31.2 p -69.75 154.27 94.88 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.501 178.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.453 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 2.4 Cg_endo -82.0 6.13 5.89 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 123.188 2.592 . . . . 0.0 112.244 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.899 -179.908 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo . . . . . 0 N--CA 1.484 0.918 0 N-CA-C 111.094 -0.387 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.406 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 65.7 p -74.22 127.28 88.1 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.987 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 94.4 Cg_endo -98.03 -159.18 0.05 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.189 2.593 . . . . 0.0 111.62 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -83.24 71.92 10.19 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.801 0.81 . . . . 0.0 110.016 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.2 tmm? -79.35 104.92 10.3 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.565 -179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 -79.53 162.86 25.12 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.77 -179.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.464 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.8 pt-20 -166.75 137.22 3.2 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.628 0.728 . . . . 0.0 110.696 179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.99 112.4 2.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.183 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.829 HD13 ' HA ' ' B' ' 38' ' ' PHE . 31.4 mt -112.74 107.29 15.88 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.695 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.646 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -101.84 81.12 2.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.53 0.681 . . . . 0.0 111.206 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 65.09 -81.97 0.07 OUTLIER Glycine 0 C--N 1.321 -0.294 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.932 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -58.0 -56.08 26.61 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 117.315 0.558 . . . . 0.0 110.871 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -52.59 -46.53 66.97 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.829 ' HA ' HD13 ' B' ' 33' ' ' LEU . 24.7 t80 -54.26 -31.01 52.53 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.187 -1.824 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.703 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.2 t -72.83 -52.49 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.533 ' NE ' HG12 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -51.53 -65.04 0.63 Allowed 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.61 0.569 . . . . 0.0 110.912 179.421 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.879 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.32 -45.88 55.09 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -47.05 -40.89 15.82 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.255 0.55 . . . . 0.0 109.813 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.703 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.6 OUTLIER -73.48 -65.13 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.029 178.342 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -34.0 -41.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.086 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.903 HG22 ' HG2' ' A' ' 122' ' ' GLN . 78.5 t -74.5 -60.37 2.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 113.417 -1.72 . . . . 0.0 112.447 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 10.2 t -124.15 -57.71 1.58 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.68 -176.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.54 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 150.55 -95.85 0.16 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.966 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.453 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . 140.19 -135.79 7.32 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.165 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.591 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 57.9 Cg_endo -70.14 -68.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.72 2.28 . . . . 0.0 112.339 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 50' ' ' ARG . . . . . 0.461 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 0.1 OUTLIER -158.62 -42.43 0.06 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.697 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.686 ' CH2' HG13 ' B' ' 39' ' ' VAL . 14.1 m95 64.1 -1.4 0.7 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.184 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 4.3 m -115.87 112.76 22.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.738 0.304 . . . . 0.0 110.783 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 12.3 p -156.59 -45.8 0.07 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.015 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -150.8 -176.33 5.48 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.562 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.105 179.988 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.785 0.326 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -83.53 132.08 34.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.973 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.53 -159.28 0.7 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.166 0.507 . . . . 0.0 111.409 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.444 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 12.7 t -75.29 -157.76 0.07 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.087 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -82.35 105.08 4.08 Favored Pre-proline 0 C--N 1.327 -0.405 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.6 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 56.9 Cg_endo -65.42 2.25 1.63 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.351 2.034 . . . . 0.0 113.335 -178.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.46 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -89.66 -52.36 5.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.367 0.604 . . . . 0.0 109.713 178.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -77.18 -24.95 51.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.194 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.6 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -63.83 -54.91 27.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.473 179.382 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.578 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.7 m -74.82 -14.13 60.65 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.586 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.612 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.0 t -76.91 -28.16 55.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.032 0.444 . . . . 0.0 110.075 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.0 mt -81.11 -34.44 32.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.699 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.442 ' HB3' ' NH1' ' B' ' 30' ' ' ARG . 3.1 m -138.33 -36.09 0.59 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.417 ' CA ' ' HA ' ' B' ' 32' ' ' LYS . . . 118.36 171.74 15.34 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.763 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.659 ' HB2' HD12 ' B' ' 33' ' ' LEU . 71.2 m -140.58 138.38 34.41 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.287 0.565 . . . . 0.0 112.463 -179.379 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.745 HG23 ' HG3' ' B' ' 30' ' ' ARG . 74.2 p -77.25 157.88 30.58 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.501 179.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.886 ' HG2' HG22 ' B' ' 45' ' ' VAL . 15.8 mt-30 -53.57 -20.63 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.614 ' O ' HG23 ' A' ' 127' ' ' THR . 97.2 mt-30 -70.53 -54.02 13.82 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.591 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -53.94 -53.03 58.45 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 178.258 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.722 HD21 HD13 ' B' ' 33' ' ' LEU . 1.1 mt -61.12 -30.72 70.54 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.629 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 7.0 mt -63.44 -27.17 69.1 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.614 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.5 OUTLIER -92.38 -16.0 26.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.902 179.759 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 14.5 mt -96.62 -1.43 46.85 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 121.561 0.696 . . . . 0.0 109.267 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.564 ' N ' ' CD ' ' A' ' 130' ' ' PRO . 36.7 t -56.73 -44.24 99.68 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 114.647 -1.16 . . . . 0.0 112.503 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 129' ' ' CYS . 60.1 Cg_endo -86.65 6.68 5.27 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.712 2.941 . . . . 0.0 112.325 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.926 179.857 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo . . . . . 0 N--CA 1.484 0.96 0 N-CA-C 111.168 -0.358 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -73.53 120.18 79.79 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.02 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -96.8 -157.41 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.124 2.549 . . . . 0.0 111.829 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.518 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 3.3 pt-20 -80.97 78.64 7.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.639 0.733 . . . . 0.0 110.046 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 46.7 ttm -83.47 10.91 7.78 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.191 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.745 ' HG3' HG23 ' A' ' 121' ' ' THR . 0.2 OUTLIER 37.67 34.78 0.06 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.405 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.409 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.8 pt-20 -66.06 155.83 35.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.42 0.628 . . . . 0.0 110.858 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.417 ' HA ' ' CA ' ' A' ' 119' ' ' GLY . 13.9 mtpt -63.16 108.2 1.21 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.625 -178.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.788 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 9.7 mt -101.91 98.86 9.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.959 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.612 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.7 t -99.83 94.09 6.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.251 0.548 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.11 -83.4 0.02 OUTLIER Glycine 0 C--N 1.321 -0.264 0 CA-C-N 115.029 -0.987 . . . . 0.0 112.991 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -60.19 -57.3 13.38 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.91 0.355 . . . . 0.0 111.493 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 8.2 m170 -52.96 -44.73 67.35 Favored 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.788 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 20.2 t80 -57.7 -28.99 64.32 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.897 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.711 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.0 OUTLIER -74.15 -60.22 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.145 177.815 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.542 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.5 OUTLIER -49.43 -64.34 0.84 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 119.414 -0.327 . . . . 0.0 110.632 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.882 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -46.05 -49.23 16.55 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.498 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.625 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.56 -41.0 6.16 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.322 0.582 . . . . 0.0 110.431 179.883 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.673 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -79.84 -59.74 2.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.489 179.595 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ARG . . . . . 0.435 ' HE ' ' HB3' ' B' ' 40' ' ' ARG . 4.8 mtt180 -36.22 -39.37 0.18 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.104 0.954 . . . . 0.0 109.335 177.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.886 HG22 ' HG2' ' A' ' 122' ' ' GLN . 59.8 t -76.02 -53.17 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 113.538 -1.664 . . . . 0.0 111.387 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 45.6 t -147.38 -63.98 0.27 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.271 -177.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.673 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 143.75 124.91 1.86 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.035 -0.984 . . . . 0.0 112.123 -177.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.686 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . -66.81 -119.31 0.02 OUTLIER Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.27 -0.491 . . . . 0.0 113.511 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.563 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 63.9 Cg_endo -70.72 -72.05 0.02 OUTLIER 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.555 2.836 . . . . 0.0 114.294 -178.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 50' ' ' ARG . . . . . 0.475 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 35.3 mmt180 -152.39 -38.25 0.11 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.715 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.711 ' CH2' HG13 ' B' ' 39' ' ' VAL . 7.8 m95 62.12 9.21 3.01 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.09 178.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 37.5 m -138.27 142.07 39.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.752 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 23.5 p -154.73 -59.43 0.11 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.917 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -82.48 13.16 3.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.344 -0.836 . . . . 0.0 111.117 179.949 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.828 0.347 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.09 -77.68 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.213 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -131.55 -161.28 1.12 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.246 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.47 HG23 ' N ' ' A' ' 110' ' ' ASN . 9.2 t -76.36 -137.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.417 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.47 ' N ' HG23 ' A' ' 109' ' ' THR . 4.7 m120 -81.77 109.42 14.81 Favored Pre-proline 0 C--N 1.331 -0.224 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.478 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 64.6 Cg_endo -71.32 88.61 0.72 Allowed 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.031 1.82 . . . . 0.0 111.631 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 164.85 -57.15 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.139 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.07 -34.34 59.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.335 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.452 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -62.19 -29.26 70.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.334 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.715 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 60.3 m -84.01 -33.91 24.42 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.813 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.596 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.6 t -54.9 -35.5 64.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 44.2 mt -82.4 -53.72 5.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.47 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 58.3 m -106.91 -58.46 1.93 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.715 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 128.64 174.22 13.67 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.372 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.999 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -133.13 155.17 49.77 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.376 0.588 . . . . 0.0 111.701 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.69 ' O ' HD12 ' A' ' 125' ' ' LEU . 67.8 p -97.71 159.94 14.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.524 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.815 ' HG2' HG22 ' B' ' 45' ' ' VAL . 16.3 mt-30 -62.13 2.67 0.22 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.632 ' O ' HG23 ' A' ' 127' ' ' THR . 50.3 mt-30 -94.92 -57.01 2.56 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.495 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 2.7 m-20 -55.41 -51.0 68.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mt -59.04 -34.73 72.25 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.097 179.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.481 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.4 mt -63.24 -30.35 71.51 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.745 0.307 . . . . 0.0 110.796 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.632 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -94.43 -5.46 46.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.519 -179.613 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.5 HD13 ' HZ ' ' B' ' 38' ' ' PHE . 95.5 mt -95.82 -20.57 18.72 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.799 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 24.7 p -58.42 148.42 64.67 Favored Pre-proline 0 C--N 1.332 -0.157 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.678 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.491 ' HG2' ' HB3' ' B' ' 49' ' ' PRO . 2.7 Cg_exo -76.46 -7.0 17.58 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.06 2.507 . . . . 0.0 112.553 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.935 179.951 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo . . . . . 0 N--CA 1.483 0.899 0 N-CA-C 111.225 -0.337 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 4.7 t -166.05 141.94 4.09 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.031 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 90.6 Cg_endo -97.8 -158.56 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.196 2.597 . . . . 0.0 112.293 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.473 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 2.8 pt-20 -81.95 77.77 8.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.606 0.717 . . . . 0.0 110.478 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 20.7 ttt -86.61 19.81 2.74 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.617 -1.174 . . . . 0.0 111.816 -179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.579 ' HG2' ' CG2' ' A' ' 121' ' ' THR . 0.0 OUTLIER 40.1 35.05 0.23 Allowed 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.07 179.377 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.494 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.9 pt-20 -64.97 152.45 43.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.526 0.679 . . . . 0.0 111.892 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 118' ' ' SER . 81.6 mttt -65.64 109.59 2.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.204 -1.362 . . . . 0.0 112.799 -177.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.999 HD12 ' SG ' ' A' ' 120' ' ' CYS . 58.7 mt -105.78 96.61 6.61 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.537 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.596 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.8 t -92.23 84.44 5.22 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.351 -179.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 63.11 -77.79 0.03 OUTLIER Glycine 0 C--N 1.32 -0.35 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.976 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.485 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 1.2 t60 -65.1 -52.46 55.3 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.32 0.56 . . . . 0.0 111.054 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.529 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 11.6 m170 -55.23 -35.32 64.81 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.774 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 47.0 t80 -69.5 -26.42 64.53 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 113.007 -1.906 . . . . 0.0 109.664 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.648 ' O ' HG23 ' B' ' 43' ' ' VAL . 2.3 t -73.71 -68.33 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 176.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.526 ' N ' HG12 ' B' ' 39' ' ' VAL . 2.4 mpt_? -43.76 -55.11 4.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.525 0.516 . . . . 0.0 110.942 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.925 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -56.12 -49.35 74.15 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.084 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -45.45 -40.88 8.8 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.469 0.652 . . . . 0.0 110.104 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.69 HG13 ' NE1' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -71.18 -62.02 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.907 178.903 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 4.9 mtt180 -38.68 -38.33 0.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.337 1.065 . . . . 0.0 109.759 177.398 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.925 HG23 ' O ' ' B' ' 41' ' ' ALA . 58.5 t -76.18 -63.38 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 113.072 -1.877 . . . . 0.0 114.024 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 7.8 t -112.9 -35.29 5.49 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.54 -176.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.549 ' C ' ' HE1' ' B' ' 51' ' ' TRP . . . 105.05 18.21 12.68 Favored Glycine 0 C--N 1.318 -0.421 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.757 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 40.87 -152.83 0.09 OUTLIER Glycine 0 CA--C 1.521 0.431 0 N-CA-C 114.015 0.366 . . . . 0.0 114.015 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.5 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 57.5 Cg_endo -84.67 47.72 2.22 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.072 2.515 . . . . 0.0 113.046 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 67.37 -23.63 0.11 Allowed 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.69 ' NE1' HG13 ' B' ' 43' ' ' VAL . 16.5 m95 56.91 15.22 2.19 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 51.1 m -52.57 165.77 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.053 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 32.8 p -154.16 -41.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.058 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -82.25 -167.71 1.68 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.381 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.068 -179.886 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.871 0.367 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -160.64 133.58 6.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.023 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.13 -164.84 1.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.201 0.525 . . . . 0.0 111.399 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.442 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 13.5 t -76.77 -156.71 0.08 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.044 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -83.0 103.88 3.04 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.62 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 43.2 Cg_endo -63.11 -1.65 3.09 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.396 2.064 . . . . 0.0 113.357 -178.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.464 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -85.87 -52.91 5.43 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.403 0.62 . . . . 0.0 109.617 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.65 -26.0 50.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.474 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.62 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -63.16 -56.24 18.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.571 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.629 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -72.98 -29.17 62.85 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.791 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.637 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.5 t -57.44 -37.58 73.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.729 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 14.3 mt -79.58 -56.44 4.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.833 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.9 m -105.27 -43.16 5.07 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.418 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 115.01 160.67 12.92 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.386 -178.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.43 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.9 m -131.21 148.17 52.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.307 0.575 . . . . 0.0 112.534 -179.251 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.829 ' O ' HD12 ' A' ' 125' ' ' LEU . 12.3 p -85.44 164.47 17.86 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.038 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.895 ' HG2' HG22 ' B' ' 45' ' ' VAL . 40.8 mt-30 -63.11 -3.68 1.9 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.213 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.632 ' O ' HG23 ' A' ' 127' ' ' THR . 8.7 mm100 -87.87 -54.28 4.32 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.6 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.49 -54.07 48.47 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.389 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.829 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -57.46 -32.8 67.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.533 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.479 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.8 mt -64.13 -27.99 69.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.852 0.358 . . . . 0.0 110.11 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.632 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -94.9 -7.35 40.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.232 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.623 HD12 ' HA ' ' A' ' 125' ' ' LEU . 34.5 mt -93.14 -17.97 23.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.759 0.314 . . . . 0.0 110.521 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 19.4 p -73.61 161.51 78.54 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.392 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.8 18.31 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.928 2.419 . . . . 0.0 112.479 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.149 -0.929 . . . . 0.0 110.887 179.864 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo . . . . . 0 N--CA 1.484 0.956 0 N-CA-C 111.244 -0.329 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 9.7 p 62.85 141.41 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.256 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.549 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 89.0 Cg_endo -93.51 -157.73 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.056 2.504 . . . . 0.0 111.835 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.57 64.26 6.21 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-O 121.787 0.804 . . . . 0.0 110.625 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 2.3 mtp -79.36 106.28 11.28 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.937 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 mtt180 -78.19 122.01 25.1 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.781 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.56 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.1 pt-20 -138.37 144.66 40.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.201 179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -62.73 112.58 2.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.923 -177.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.793 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 4.8 mt -106.42 99.68 9.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.421 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.637 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -99.98 98.74 9.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.395 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 56.66 -83.27 0.01 OUTLIER Glycine 0 C--N 1.322 -0.242 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.057 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.446 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.3 t-160 -63.4 -55.14 26.78 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 117.281 0.541 . . . . 0.0 111.439 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -53.06 -42.84 66.21 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.793 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 19.7 t80 -60.09 -30.58 69.34 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.001 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.723 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.4 t -72.76 -64.2 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.604 ' HE ' HG12 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -42.71 -62.63 0.95 Allowed 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 123.617 0.573 . . . . 0.0 110.634 179.065 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.846 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.0 -52.72 40.0 Favored 'General case' 0 C--O 1.21 -0.975 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.233 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.79 -38.81 3.43 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.042 0.448 . . . . 0.0 110.439 -179.88 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.666 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -76.98 -64.4 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.055 179.058 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 -33.83 -43.56 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.468 1.128 . . . . 0.0 110.136 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.895 HG22 ' HG2' ' A' ' 122' ' ' GLN . 57.3 t -72.47 -58.86 4.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 112.799 -2.001 . . . . 0.0 112.676 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.5 t -127.54 -59.42 1.22 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.508 -176.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.535 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 154.96 -106.9 0.3 Allowed Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.679 -178.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.411 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 150.62 -144.56 11.99 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.437 -0.887 . . . . 0.0 112.447 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.553 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 95.9 Cg_endo -80.06 38.13 0.72 Allowed 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.702 2.268 . . . . 0.0 112.225 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 72.15 -27.06 0.18 Allowed 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.891 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.723 ' CH2' HG13 ' B' ' 39' ' ' VAL . 12.4 m95 62.61 129.21 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 121.942 0.877 . . . . 0.0 112.575 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 52' ' ' SER . . . . . 0.423 ' O ' HG23 ' B' ' 53' ' ' THR . 68.3 m 62.01 148.84 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.022 -1.444 . . . . 0.0 111.506 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.423 HG23 ' O ' ' B' ' 52' ' ' SER . 0.8 OUTLIER -158.96 -56.61 0.07 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.096 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 45.06 46.91 9.61 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.329 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.128 -179.897 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.853 0.358 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -160.69 23.89 0.15 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -128.89 -161.0 1.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.162 0.506 . . . . 0.0 111.298 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.5 t -76.97 -159.86 0.14 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.874 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -82.68 104.9 3.99 Favored Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.663 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 33.9 Cg_endo -59.62 -21.31 61.97 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.296 1.997 . . . . 0.0 113.178 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.469 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -67.52 -53.96 24.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.237 0.541 . . . . 0.0 110.417 179.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -21.35 52.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.566 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.663 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -71.02 -51.29 26.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.983 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.587 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.4 m -74.56 -19.09 60.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.113 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.64 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.3 t -71.12 -48.58 51.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.786 0.326 . . . . 0.0 111.164 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.1 mt -80.85 -15.08 57.3 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 47.8 t -134.44 -52.73 0.82 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.494 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 115.69 147.78 9.12 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.448 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.628 ' HB2' HD12 ' B' ' 33' ' ' LEU . 95.4 m -122.67 140.7 52.56 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.733 ' O ' HD12 ' A' ' 125' ' ' LEU . 75.3 p -76.72 155.51 33.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.756 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.891 ' HG2' HG22 ' B' ' 45' ' ' VAL . 20.2 mt-30 -55.15 -20.25 9.75 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.57 ' O ' HG23 ' A' ' 127' ' ' THR . 6.9 mp0 -69.84 -51.83 30.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.622 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -54.63 -57.11 12.72 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.019 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.741 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -56.21 -30.75 62.75 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.64 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.2 mt -62.88 -31.71 72.81 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.069 0.461 . . . . 0.0 109.847 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.57 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -100.54 -1.44 35.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.707 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 72.7 mt -93.31 -19.32 21.47 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.129 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.459 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 17.2 p -73.28 162.26 75.26 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.253 178.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.503 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 6.8 Cg_exo -74.46 -72.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.725 2.283 . . . . 0.0 112.212 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 . . . . . 0 C--O 1.249 1.046 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.907 179.992 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 25' ' ' PRO . . . . . 0.483 ' O ' HG23 ' B' ' 26' ' ' THR . 3.5 Cg_endo . . . . . 0 N--CA 1.483 0.901 0 N-CA-C 111.145 -0.367 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.483 HG23 ' O ' ' B' ' 25' ' ' PRO . 3.2 p -160.9 143.1 9.29 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.727 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -89.01 -158.73 0.08 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.647 2.232 . . . . 0.0 111.887 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.44 ' HB3' ' OE1' ' A' ' 123' ' ' GLN . 5.8 pt-20 -82.2 64.38 6.83 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.861 0.838 . . . . 0.0 110.645 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 22.9 ttt -83.77 12.28 6.22 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.864 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.566 ' NH1' ' HA ' ' A' ' 120' ' ' CYS . 1.3 mtt-85 51.3 173.53 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.12 -0.946 . . . . 0.0 112.678 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.557 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.3 tp10 173.89 139.4 0.04 OUTLIER 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.978 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 60.4 mttt -68.14 101.99 1.26 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.431 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.77 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.5 mt -99.91 98.44 9.22 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.42 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.9 t -98.71 94.57 6.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.167 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.49 -80.6 0.01 OUTLIER Glycine 0 C--N 1.32 -0.357 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.901 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 3.5 t-160 -65.98 -55.24 17.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.184 0.492 . . . . 0.0 111.494 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.459 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -53.14 -36.85 61.28 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 177.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.77 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.9 t80 -67.72 -29.22 68.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 112.988 -1.914 . . . . 0.0 109.822 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.701 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.5 t -73.11 -65.61 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.387 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.52 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.9 OUTLIER -48.34 -58.6 4.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 119.204 -0.426 . . . . 0.0 110.934 179.221 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.8 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.53 -47.07 57.69 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.519 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.628 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.17 -39.24 13.35 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.205 0.526 . . . . 0.0 110.275 179.582 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.746 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -79.76 -62.48 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.382 179.697 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mtt180 -32.25 -40.8 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.437 1.113 . . . . 0.0 108.866 176.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.891 HG22 ' HG2' ' A' ' 122' ' ' GLN . 91.2 t -74.93 -66.43 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 112.949 -1.932 . . . . 0.0 112.215 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 47.7 t -127.79 -62.08 1.09 Allowed 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.057 -175.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.746 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 126.41 112.16 1.79 Allowed Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.611 -178.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.503 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . -62.25 -117.65 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 121.057 -0.592 . . . . 0.0 111.998 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.65 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 55.8 Cg_endo -68.74 -137.9 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.768 2.312 . . . . 0.0 111.516 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 50' ' ' ARG . . . . . 0.443 ' H ' ' HB2' ' B' ' 49' ' ' PRO . 22.5 mmm180 -85.26 -40.09 17.0 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.701 ' CH2' HG13 ' B' ' 39' ' ' VAL . 37.2 m95 70.74 -21.76 0.19 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -179.254 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' SER . . . . . 0.432 ' H ' ' C ' ' B' ' 50' ' ' ARG . 11.4 m -140.17 118.5 12.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.872 0.368 . . . . 0.0 110.968 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.92 -70.51 0.07 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.081 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -83.49 5.83 22.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.298 -179.839 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.799 0.333 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.41 154.93 24.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.016 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -135.59 -155.27 0.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.228 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.491 HG23 ' N ' ' A' ' 110' ' ' ASN . 14.8 t -75.53 -143.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.264 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.491 ' N ' HG23 ' A' ' 109' ' ' THR . 16.4 m120 -78.46 113.28 32.96 Favored Pre-proline 0 C--N 1.33 -0.255 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.585 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 62.1 Cg_endo -69.07 -8.68 24.26 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.276 1.984 . . . . 0.0 112.923 -178.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.24 -39.28 10.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.292 0.568 . . . . 0.0 110.966 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -77.49 -52.3 9.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.334 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.585 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -54.8 -31.59 59.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.732 -178.824 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.725 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 68.1 m -79.92 -22.18 43.03 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.956 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.627 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.8 t -70.6 -33.94 71.6 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.4 mt -84.12 -24.72 30.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.155 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.474 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 78.1 p -136.58 -63.04 0.64 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.753 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.725 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.21 156.11 8.76 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.761 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.968 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -107.96 155.85 19.87 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 121.666 0.746 . . . . 0.0 112.213 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 125' ' ' LEU . 32.7 p -94.84 151.27 19.37 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.441 178.246 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.919 ' HG2' HG22 ' B' ' 45' ' ' VAL . 9.9 mt-30 -56.56 -8.07 0.5 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.611 ' O ' HG23 ' A' ' 127' ' ' THR . 18.7 mm-40 -83.46 -54.96 4.58 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.554 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 1.7 t70 -54.27 -54.71 36.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.674 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -56.67 -34.01 66.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.442 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.9 mt -62.89 -29.57 70.87 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.919 0.39 . . . . 0.0 110.572 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -99.75 -2.08 36.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.386 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.572 HD12 ' HA ' ' A' ' 125' ' ' LEU . 72.0 mt -92.96 -23.33 18.75 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.727 0.299 . . . . 0.0 110.694 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 25.2 p -62.72 146.07 94.94 Favored Pre-proline 0 C--O 1.232 0.137 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.419 178.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 129' ' ' CYS . 1.2 Cg_endo -84.69 -76.32 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.456 2.771 . . . . 0.0 112.537 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.34 -0.838 . . . . 0.0 110.919 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 25' ' ' PRO . . . . . 0.492 ' O ' HG23 ' B' ' 26' ' ' THR . 1.7 Cg_endo . . . . . 0 N--CA 1.483 0.909 0 N-CA-C 111.168 -0.358 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.492 HG23 ' O ' ' B' ' 25' ' ' PRO . 1.1 p -161.78 133.64 4.09 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.917 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 91.4 Cg_endo -96.45 -156.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.251 2.634 . . . . 0.0 112.08 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.537 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 3.3 pt-20 -80.14 78.76 6.77 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.595 0.712 . . . . 0.0 110.251 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.431 ' O ' ' HG3' ' B' ' 29' ' ' MET . 6.0 tpt -84.95 9.97 13.04 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.684 -1.143 . . . . 0.0 111.494 -179.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.662 ' HG3' HG23 ' A' ' 121' ' ' THR . 0.0 OUTLIER 37.54 91.59 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.227 178.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.63 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 4.7 tp10 -110.06 150.28 28.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.234 0.54 . . . . 0.0 111.265 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 118' ' ' SER . 4.0 mtpm? -63.24 100.02 0.21 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.62 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.968 HD12 ' SG ' ' A' ' 120' ' ' CYS . 63.4 mt -100.24 102.25 13.48 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.826 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.627 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.1 t -98.14 76.86 2.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.361 0.6 . . . . 0.0 111.223 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.27 -75.61 0.5 Allowed Glycine 0 C--N 1.319 -0.373 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.857 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.46 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 5.2 t-160 -66.63 -53.17 37.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.496 0.648 . . . . 0.0 110.841 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.5 m170 -53.7 -38.17 63.99 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.802 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 37.8 t80 -64.75 -30.25 71.26 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.037 -1.892 . . . . 0.0 109.835 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.685 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.5 t -71.09 -66.32 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.562 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -46.26 -61.35 1.82 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 119.38 -0.343 . . . . 0.0 110.408 178.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.863 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -48.35 -50.14 31.61 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.513 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.679 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -45.16 -41.56 8.21 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.3 0.571 . . . . 0.0 110.067 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.672 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -74.81 -64.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.191 179.165 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 5.5 mtt180 -33.28 -41.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 122.289 1.042 . . . . 0.0 109.86 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.919 HG22 ' HG2' ' A' ' 122' ' ' GLN . 59.3 t -74.05 -58.54 4.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 113.277 -1.783 . . . . 0.0 112.561 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 22.2 t -129.89 -60.21 1.04 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.277 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.656 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 126.57 116.25 2.03 Favored Glycine 0 C--N 1.321 -0.303 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.445 -177.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.686 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . -61.87 -125.25 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.36 -0.447 . . . . 0.0 113.736 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.498 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 60.5 Cg_endo -69.38 -69.24 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 123.116 2.544 . . . . 0.0 113.004 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 50' ' ' ARG . . . . . 0.491 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 0.2 OUTLIER -156.56 -39.93 0.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.931 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.686 ' HE1' ' N ' ' B' ' 48' ' ' GLY . 11.2 m95 69.52 -67.32 0.23 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.208 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' SER . . . . . 0.404 ' H ' ' H ' ' B' ' 53' ' ' THR . 63.8 m -158.65 -11.79 0.07 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.924 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.404 ' H ' ' H ' ' B' ' 52' ' ' SER . 70.1 p -80.43 -47.42 14.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.277 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 46.54 69.42 0.49 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.256 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.082 -179.925 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.875 0.369 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -149.26 -178.17 6.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.944 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 59.36 -175.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.513 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.541 HG23 ' H ' ' A' ' 110' ' ' ASN . 0.8 OUTLIER -163.25 -53.19 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.241 -179.726 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.541 ' H ' HG23 ' A' ' 109' ' ' THR . 1.6 m120 -158.21 82.73 2.78 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.195 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 17.8 Cg_endo -53.62 90.9 0.03 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.334 2.023 . . . . 0.0 111.762 -178.461 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 156.47 -62.09 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 113.998 -1.455 . . . . 0.0 107.434 -178.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.84 -18.8 53.43 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.951 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.483 ' HB2' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -72.55 -56.25 5.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.857 -179.585 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.612 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -74.35 -21.73 59.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.904 0.383 . . . . 0.0 110.923 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.653 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.7 t -68.99 -47.85 64.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.9 0.381 . . . . 0.0 110.903 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.2 mt -81.8 -17.5 47.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.287 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 t -132.21 -54.79 0.97 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.565 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 116.95 149.21 9.02 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.509 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.539 ' HA ' HH11 ' B' ' 30' ' ' ARG . 78.0 m -127.22 146.28 50.47 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.225 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.808 ' O ' HD12 ' A' ' 125' ' ' LEU . 65.9 p -87.23 165.06 15.97 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.833 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.842 ' HG2' HG22 ' B' ' 45' ' ' VAL . 14.3 mt-30 -61.68 -0.59 0.46 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 177.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.665 ' O ' HG23 ' A' ' 127' ' ' THR . 79.7 mt-30 -89.85 -54.37 4.08 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 176.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.53 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -57.99 -50.12 74.5 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.808 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mp -60.48 -31.72 70.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.24 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.452 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.2 mt -64.55 -28.43 69.64 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 120.961 0.41 . . . . 0.0 110.007 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -95.58 -5.57 42.3 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.501 -179.795 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 44.5 mt -96.44 -18.62 19.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.175 -179.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.459 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 32.0 p -67.91 150.66 97.68 Favored Pre-proline 0 C--N 1.331 -0.206 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.527 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 129' ' ' CYS . 1.4 Cg_endo -85.69 -7.51 8.53 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.283 2.655 . . . . 0.0 112.36 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.892 -179.916 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 N--CA 1.484 0.937 0 N-CA-C 111.067 -0.397 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.9 t -166.49 144.24 4.38 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.385 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -93.03 -156.08 0.05 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.202 2.602 . . . . 0.0 112.057 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' B' ' 30' ' ' ARG . 12.6 mm-40 -78.49 -14.51 59.33 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 121.835 0.826 . . . . 0.0 110.249 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 29' ' ' MET . . . . . 0.46 ' HG2' ' O ' ' B' ' 29' ' ' MET . 53.5 ttm 37.02 26.01 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.551 -1.658 . . . . 0.0 112.647 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.594 ' CD ' HG23 ' A' ' 121' ' ' THR . 7.7 mmt180 46.29 -158.07 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.753 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.631 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.2 tp10 175.85 132.83 0.04 OUTLIER 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.691 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 57.6 mttt -65.92 102.42 0.78 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.565 0.698 . . . . 0.0 112.133 -178.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.769 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.0 mt -103.94 100.38 10.16 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.581 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.653 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -99.9 92.28 5.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.88 -80.25 0.02 OUTLIER Glycine 0 C--N 1.322 -0.235 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.889 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.498 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 4.1 t-160 -65.19 -55.66 17.32 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 117.337 0.568 . . . . 0.0 111.182 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.455 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.7 m-70 -52.95 -37.53 61.15 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.769 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 25.4 t80 -67.14 -27.94 67.72 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.02 -1.9 . . . . 0.0 109.786 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.667 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.0 OUTLIER -74.46 -65.77 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.226 177.496 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.589 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -46.01 -57.97 3.97 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 119.385 -0.341 . . . . 0.0 110.848 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.882 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.0 -51.74 55.26 Favored 'General case' 0 C--O 1.212 -0.914 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.975 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.641 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -42.45 -38.06 1.79 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.281 0.562 . . . . 0.0 110.473 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.64 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.3 OUTLIER -77.31 -64.78 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.1 179.073 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 5.0 mtt180 -34.21 -40.8 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 122.464 1.126 . . . . 0.0 109.767 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.882 HG23 ' O ' ' B' ' 41' ' ' ALA . 60.8 t -74.51 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.778 -179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 9.0 t -121.64 -58.94 1.73 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.538 -176.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.505 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 149.29 -101.51 0.22 Allowed Glycine 0 C--N 1.321 -0.281 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.961 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.496 ' CA ' ' HE1' ' B' ' 51' ' ' TRP . . . 139.1 -134.0 6.5 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.478 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.643 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 57.5 Cg_endo -69.49 -69.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.927 2.418 . . . . 0.0 113.149 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 50' ' ' ARG . . . . . 0.433 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 0.5 OUTLIER -155.98 -45.66 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.073 0.463 . . . . 0.0 111.279 -179.038 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.667 ' CH2' HG13 ' B' ' 39' ' ' VAL . 16.5 m95 63.35 -1.79 0.52 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.578 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' SER . . . . . 0.402 ' H ' ' C ' ' B' ' 50' ' ' ARG . 74.2 m 58.17 171.93 0.06 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.897 0.38 . . . . 0.0 111.419 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 21.1 p -155.59 -46.63 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.93 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -82.67 25.89 0.62 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.102 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.067 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.22 114.33 15.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.314 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -102.83 -159.73 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.709 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.476 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 14.7 t -74.99 -155.72 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.446 ' O ' ' HB3' ' A' ' 114' ' ' TYR . 2.3 m-20 -84.77 101.59 1.68 Allowed Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.476 ' HD3' ' O ' ' A' ' 109' ' ' THR . 41.8 Cg_endo -62.72 0.83 1.29 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.375 2.05 . . . . 0.0 112.989 -178.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.13 -49.62 5.91 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.448 0.642 . . . . 0.0 109.54 178.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.6 mmm180 -78.51 -23.86 46.1 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.911 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.462 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -70.08 -51.21 33.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.773 179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.571 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 4.5 m -75.49 -16.03 60.35 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.679 -0.409 . . . . 0.0 110.957 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.643 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.9 t -71.57 -53.02 15.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.857 0.361 . . . . 0.0 111.272 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.8 mt -79.84 -13.94 59.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.338 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.7 t -129.29 -55.63 1.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.462 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 114.4 144.11 8.5 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.565 ' HB2' HD12 ' B' ' 33' ' ' LEU . 89.8 m -122.03 142.59 50.17 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.748 ' O ' HD12 ' A' ' 125' ' ' LEU . 73.3 p -75.81 157.05 33.88 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.648 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.731 ' HG2' HG22 ' B' ' 45' ' ' VAL . 21.7 mt-30 -58.83 -14.46 8.92 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.224 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.627 ' O ' HG23 ' A' ' 127' ' ' THR . 71.0 mt-30 -74.31 -51.96 13.65 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.628 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.4 OUTLIER -52.66 -57.39 10.22 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.977 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.756 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -54.36 -34.43 61.14 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.488 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.459 HD23 ' HB2' ' B' ' 46' ' ' CYS . 6.3 mt -60.76 -32.94 72.22 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.184 0.516 . . . . 0.0 110.001 178.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.627 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -90.94 -9.46 46.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.631 -179.565 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 27.5 mt -92.02 -13.42 30.99 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 120.965 0.412 . . . . 0.0 110.069 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.636 ' HA ' ' HA2' ' B' ' 48' ' ' GLY . 1.6 p -83.64 175.97 4.22 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.134 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.649 ' HD3' ' H ' ' B' ' 48' ' ' GLY . 16.4 Cg_exo -68.19 -159.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.383 2.055 . . . . 0.0 112.388 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.122 -179.995 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.485 0.981 0 N-CA-C 110.957 -0.439 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 61.9 p -72.59 133.81 82.4 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.997 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -97.63 -157.17 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.316 2.677 . . . . 0.0 111.842 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -82.16 75.09 9.1 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.637 0.732 . . . . 0.0 110.433 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 16.6 ttm -80.18 114.93 19.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.827 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -79.7 163.07 24.82 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.021 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 5.5 tp10 -176.74 139.99 0.32 Allowed 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.937 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -67.42 101.84 1.03 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.387 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.718 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.2 mt -97.26 96.68 8.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.324 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.643 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -97.66 88.7 4.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.049 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.553 ' O ' HG23 ' B' ' 39' ' ' VAL . . . 64.22 -78.23 0.05 OUTLIER Glycine 0 C--N 1.318 -0.426 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.639 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.541 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 0.6 OUTLIER -66.37 -54.42 24.7 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 117.336 0.568 . . . . 0.0 111.659 179.923 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.493 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 6.8 m-70 -54.51 -34.26 61.35 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.718 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 27.3 t80 -71.68 -27.04 62.78 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.167 -1.833 . . . . 0.0 109.654 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.7 HG13 ' CH2' ' B' ' 51' ' ' TRP . 2.3 t -73.61 -62.53 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.615 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.441 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.2 OUTLIER -60.72 -42.48 97.35 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.022 179.272 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.748 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -61.03 -40.85 95.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.438 1.017 . . . . 0.0 109.225 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.612 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.6 -47.02 67.21 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.125 0.488 . . . . 0.0 111.28 179.834 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.608 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.1 OUTLIER -76.09 -49.24 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.174 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ARG . . . . . 0.439 ' HD3' ' C ' ' B' ' 44' ' ' ARG . 0.0 OUTLIER -43.91 -40.58 4.67 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-O 122.864 1.316 . . . . 0.0 107.764 177.874 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.756 HG21 ' HB2' ' A' ' 125' ' ' LEU . 56.0 t -74.05 -62.66 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.195 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.459 ' HB2' HD23 ' A' ' 126' ' ' LEU . 49.1 t -141.31 -60.73 0.48 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 113.917 -1.492 . . . . 0.0 111.927 -176.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.608 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 170.87 -90.53 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.46 -178.237 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.649 ' H ' ' HD3' ' A' ' 130' ' ' PRO . . . 123.12 -124.4 5.62 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.471 -0.652 . . . . 0.0 111.471 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.583 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 38.2 Cg_endo -65.21 -140.38 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.877 2.384 . . . . 0.0 112.021 178.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 50' ' ' ARG . . . . . 0.49 ' H ' ' HB2' ' B' ' 49' ' ' PRO . 79.7 mtt180 -80.96 -58.28 3.15 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.7 ' CH2' HG13 ' B' ' 39' ' ' VAL . 35.4 m95 71.76 -10.89 0.8 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.867 -178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' SER . . . . . 0.4 ' H ' ' C ' ' B' ' 50' ' ' ARG . 56.1 m 62.51 143.07 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.451 -179.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 55.5 p -154.99 -41.92 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.86 24.59 0.73 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.224 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.022 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.269 0 CA-C-O 120.649 0.261 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 63.92 153.93 0.05 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.297 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -116.88 -167.17 1.25 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.25 0.547 . . . . 0.0 111.436 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 12.4 t -78.1 -161.53 0.27 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.108 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -82.71 106.2 6.37 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.497 ' HB2' ' CZ ' ' B' ' 38' ' ' PHE . 31.2 Cg_endo -60.13 -14.93 31.2 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.165 1.91 . . . . 0.0 112.812 -178.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.456 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -72.36 -49.17 36.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.254 0.549 . . . . 0.0 110.118 179.127 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.448 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.7 OUTLIER -78.3 -35.15 48.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.879 178.901 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.494 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -59.97 -56.66 18.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.135 179.842 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.572 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 9.3 m -69.38 -16.41 63.51 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.287 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.628 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -71.34 -46.72 59.9 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.599 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 9.0 mt -80.58 -16.59 53.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 80.5 p -133.68 -51.48 0.85 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.401 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 117.98 160.85 11.75 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.521 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 92.1 m -136.89 143.46 43.0 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.766 ' O ' HD12 ' A' ' 125' ' ' LEU . 82.3 p -80.82 161.29 24.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.554 179.245 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.922 ' HG2' HG22 ' B' ' 45' ' ' VAL . 27.8 mt-30 -58.28 -15.17 9.17 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.654 ' O ' HG23 ' A' ' 127' ' ' THR . 93.2 mt-30 -73.77 -54.68 7.49 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.602 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -54.45 -55.33 29.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.848 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.766 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mp -58.83 -31.08 68.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.965 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 6.8 mt -64.77 -27.6 69.01 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.866 0.365 . . . . 0.0 110.158 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -97.94 -6.52 32.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.266 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 40.7 mt -94.76 -16.2 23.22 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.748 0.309 . . . . 0.0 110.702 -179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 30.6 p -73.88 154.66 88.99 Favored Pre-proline 0 CA--C 1.529 0.152 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.775 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -81.48 17.34 1.51 Allowed 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.218 2.612 . . . . 0.0 112.465 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.998 179.917 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 111.112 -0.38 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.405 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 4.1 t -165.42 143.13 4.91 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.112 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 98.0 Cg_endo -94.11 70.76 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.132 2.555 . . . . 0.0 112.17 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.456 ' OE2' ' HG3' ' A' ' 123' ' ' GLN . 1.3 mt-10 38.69 69.26 0.28 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.403 0.621 . . . . 0.0 111.535 -179.155 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 39.4 ttp -82.7 16.39 2.22 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.038 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 55.77 174.28 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.162 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.578 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.0 tp10 -178.64 136.25 0.15 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.399 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -64.65 102.54 0.58 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.793 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.772 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 34.2 mt -99.58 104.88 16.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.14 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.628 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.6 OUTLIER -103.26 95.31 6.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.447 0.641 . . . . 0.0 111.124 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 58.97 -87.66 0.02 OUTLIER Glycine 0 C--O 1.227 -0.299 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.17 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.497 ' O ' ' HG3' ' B' ' 40' ' ' ARG . 2.3 t60 -59.02 -56.63 19.8 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 117.206 0.503 . . . . 0.0 111.597 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -48.74 -48.78 40.38 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.772 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 22.6 t80 -55.94 -31.28 62.8 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 112.994 -1.912 . . . . 0.0 110.424 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.704 ' O ' HG23 ' B' ' 43' ' ' VAL . 0.5 OUTLIER -72.79 -45.04 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.787 178.189 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' B' ' 36' ' ' HIS . 1.9 mtt180 -61.09 -61.03 2.87 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.879 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.825 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.68 -45.56 66.88 Favored 'General case' 0 C--O 1.208 -1.098 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -45.84 -38.65 7.53 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.349 0.595 . . . . 0.0 109.724 179.433 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.739 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.4 OUTLIER -76.72 -63.41 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.4 178.79 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtm180 -36.7 -40.62 0.27 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.439 1.114 . . . . 0.0 110.195 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.922 HG22 ' HG2' ' A' ' 122' ' ' GLN . 99.4 t -75.19 -65.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 112.949 -1.932 . . . . 0.0 113.4 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t -109.63 -38.2 5.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.613 -176.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.415 ' O ' ' C ' ' B' ' 48' ' ' GLY . . . 101.02 7.5 50.0 Favored Glycine 0 CA--C 1.506 -0.512 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.421 -178.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' B' ' 47' ' ' GLY . . . 28.91 -133.36 0.06 OUTLIER Glycine 0 C--N 1.335 0.519 0 O-C-N 124.083 0.52 . . . . 0.0 113.51 179.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.568 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 60.3 Cg_endo -69.65 -136.85 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.518 0 C-N-CA 122.926 2.417 . . . . 0.0 112.368 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 50' ' ' ARG . . . . . 0.449 ' H ' ' HB2' ' B' ' 49' ' ' PRO . 32.6 mtt180 -81.78 -53.98 5.75 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.739 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 49.1 m95 71.2 1.42 3.82 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.157 -178.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 2.6 m -147.4 105.98 3.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.889 0.376 . . . . 0.0 111.099 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 15.3 p -156.86 82.75 0.95 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.828 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.86 -8.19 58.88 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.896 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.433 -179.945 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.796 0.331 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -132.65 165.67 23.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.204 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -133.34 -144.88 0.23 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.89 -179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.442 HG23 ' N ' ' A' ' 110' ' ' ASN . 9.7 t -74.79 -140.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.314 179.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.442 ' N ' HG23 ' A' ' 109' ' ' THR . 2.7 m-20 -79.69 112.62 30.74 Favored Pre-proline 0 C--N 1.328 -0.344 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.584 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 42.7 Cg_endo -64.57 -10.99 26.57 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.292 1.994 . . . . 0.0 112.817 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.28 -46.27 6.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.948 0.404 . . . . 0.0 111.706 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.5 OUTLIER -76.89 -40.5 47.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.654 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.584 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -59.83 -34.82 73.58 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.811 -179.39 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.783 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 73.5 m -77.5 -21.05 53.35 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.071 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.603 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.3 t -65.41 -43.4 90.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 20.9 mt -84.29 -20.71 31.69 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.215 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.514 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 43.2 t -127.53 -75.86 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 111.364 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.783 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 132.76 155.03 7.73 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.124 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.983 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -114.48 149.75 35.87 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.538 0.685 . . . . 0.0 112.273 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.795 HG23 ' HG3' ' B' ' 30' ' ' ARG . 39.0 p -87.89 150.86 23.24 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.051 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.901 ' HG2' HG22 ' B' ' 45' ' ' VAL . 24.3 mt-30 -53.06 -19.22 2.58 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.525 ' O ' HG23 ' A' ' 127' ' ' THR . 0.0 OUTLIER -72.55 -53.61 11.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.503 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 6.0 t70 -55.1 -52.18 64.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.83 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.1 mt -59.01 -31.9 69.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.856 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.532 ' HG ' HG13 ' B' ' 45' ' ' VAL . 7.7 mt -63.3 -28.94 70.36 Favored 'General case' 0 C--O 1.231 0.095 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.052 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -98.09 -3.89 36.97 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.376 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.83 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.1 mt -91.24 -21.34 21.15 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.759 0.314 . . . . 0.0 110.444 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 2.9 p -79.22 166.11 44.02 Favored Pre-proline 0 C--O 1.232 0.14 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.14 178.198 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -81.3 -169.06 0.71 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.982 2.455 . . . . 0.0 111.956 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.312 -0.851 . . . . 0.0 111.233 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo . . . . . 0 N--CA 1.485 1.028 0 N-CA-C 111.344 -0.291 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.422 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 68.0 p -73.74 135.93 77.58 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.901 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 96.8 Cg_endo -95.97 -159.31 0.05 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 123.043 2.495 . . . . 0.0 111.676 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.512 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 3.9 pt-20 -81.0 77.93 7.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.736 0.779 . . . . 0.0 110.324 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 39.7 ttp -83.28 15.55 2.89 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.865 -179.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.795 ' HG3' HG23 ' A' ' 121' ' ' THR . 0.0 OUTLIER 36.81 84.43 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.001 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.514 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.3 pt-20 -107.49 154.44 21.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.62 0.724 . . . . 0.0 111.325 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 118' ' ' SER . 79.8 mttt -60.19 104.94 0.36 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.288 -1.324 . . . . 0.0 112.604 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.983 HD12 ' SG ' ' A' ' 120' ' ' CYS . 63.9 mt -101.33 98.79 9.12 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.186 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.603 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.3 t -94.9 78.32 3.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.388 0.613 . . . . 0.0 111.19 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 67.43 -75.15 0.2 Allowed Glycine 0 C--N 1.32 -0.319 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.744 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.508 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 1.1 t60 -65.81 -52.23 52.35 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 117.237 0.519 . . . . 0.0 110.912 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.528 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.8 m170 -55.44 -36.99 67.11 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 176.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.791 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 39.4 t80 -67.21 -27.3 67.14 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 112.987 -1.915 . . . . 0.0 109.683 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.711 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.6 t -73.13 -66.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-N 115.118 -0.947 . . . . 0.0 108.811 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.546 ' N ' HG12 ' B' ' 39' ' ' VAL . 2.5 mpt_? -48.65 -59.64 3.37 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 119.267 -0.396 . . . . 0.0 110.461 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.845 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -48.45 -43.81 34.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.805 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.663 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.94 -42.85 65.84 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 121.033 0.444 . . . . 0.0 110.332 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.712 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -74.45 -59.5 3.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.128 179.214 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 44' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mmm180 -33.56 -40.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.437 1.113 . . . . 0.0 108.504 176.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.901 HG22 ' HG2' ' A' ' 122' ' ' GLN . 75.0 t -75.84 -65.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 112.997 -1.91 . . . . 0.0 111.751 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 31.8 t -135.74 -61.67 0.71 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.225 -1.352 . . . . 0.0 111.671 -176.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.712 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 120.62 110.67 2.24 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.339 -0.846 . . . . 0.0 113.168 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.04 -97.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.954 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.654 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 77.1 Cg_endo -75.84 -161.07 0.12 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.839 3.026 . . . . 0.0 110.987 178.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.42 -18.92 30.51 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.711 ' CH2' HG13 ' B' ' 39' ' ' VAL . 18.7 m95 62.38 6.45 1.92 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.881 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 4.6 m -113.96 112.31 23.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.903 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 19.0 p -155.38 81.62 1.05 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.943 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 45.45 -160.92 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.651 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.079 179.857 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.779 0.323 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -151.66 1.63 0.37 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.159 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -107.94 128.33 54.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.282 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.481 HG23 ' H ' ' A' ' 110' ' ' ASN . 0.1 OUTLIER 33.79 -99.07 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.331 -179.957 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.481 ' H ' HG23 ' A' ' 109' ' ' THR . 3.0 m120 -155.42 96.73 2.42 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.54 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.478 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 27.2 Cg_endo -58.74 89.85 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 121.984 1.789 . . . . 0.0 111.229 -179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 160.76 -63.34 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 114.52 -1.218 . . . . 0.0 107.841 -179.103 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.06 -16.46 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.979 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.409 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -73.25 -46.1 52.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.599 179.643 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.588 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.2 m -83.06 -20.64 34.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.391 . . . . 0.0 110.825 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.661 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.4 t -69.72 -50.31 44.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.6 mt -80.95 -14.88 57.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.024 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 27.2 t -131.91 -59.23 0.95 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.584 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.3 147.48 7.89 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 -178.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.578 ' HB2' HD12 ' B' ' 33' ' ' LEU . 94.4 m -123.06 145.0 48.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.803 ' O ' HD12 ' A' ' 125' ' ' LEU . 39.9 p -82.21 157.91 23.77 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.742 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.922 ' HG2' HG22 ' B' ' 45' ' ' VAL . 7.0 mt-30 -56.85 -18.61 13.67 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.69 ' O ' HG23 ' A' ' 127' ' ' THR . 47.2 mt-30 -72.15 -52.07 18.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.577 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.3 OUTLIER -54.62 -57.01 13.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.471 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.803 HD12 ' O ' ' A' ' 121' ' ' THR . 1.3 mp -59.26 -28.87 67.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.144 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.431 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 7.1 mt -66.79 -27.01 67.23 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.857 0.36 . . . . 0.0 110.084 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -100.95 -3.73 28.96 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.354 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.678 HD12 ' HA ' ' A' ' 125' ' ' LEU . 28.2 mt -93.35 -20.79 20.02 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 120.854 0.359 . . . . 0.0 110.369 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.48 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 27.7 p -66.8 155.16 90.3 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.401 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.405 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 3.4 Cg_exo -77.4 160.57 32.18 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.115 2.543 . . . . 0.0 112.24 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.362 -0.828 . . . . 0.0 111.101 -179.885 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo . . . . . 0 N--CA 1.485 0.984 0 N-CA-C 111.475 -0.241 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.5 t -73.25 141.9 81.33 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.167 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -94.2 -160.04 0.07 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.124 2.55 . . . . 0.0 112.41 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.32 56.89 3.97 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.959 0.885 . . . . 0.0 111.493 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.76 110.77 9.32 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.771 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -75.6 161.42 29.14 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.19 -0.913 . . . . 0.0 112.095 -178.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.2 tp10 -169.36 141.87 2.57 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.788 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 12.7 mtpt -69.86 102.74 2.02 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.688 0.756 . . . . 0.0 111.612 -178.77 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.765 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.2 mt -100.91 101.59 12.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.386 -1.279 . . . . 0.0 111.743 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.661 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -98.6 91.25 5.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.305 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.72 -79.5 0.01 OUTLIER Glycine 0 C--N 1.321 -0.258 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.914 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.477 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 3.4 t-160 -63.6 -54.94 28.08 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.106 0.453 . . . . 0.0 111.191 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.403 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 4.5 m-70 -54.96 -38.31 67.6 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.217 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.765 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 26.5 t80 -65.25 -26.99 68.34 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.062 -1.881 . . . . 0.0 109.626 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.681 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.4 t -74.38 -65.11 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.561 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.1 OUTLIER -43.69 -62.37 1.12 Allowed 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 123.259 0.349 . . . . 0.0 110.721 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.762 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.54 -50.85 52.27 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 119.807 -0.757 . . . . 0.0 109.032 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.669 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -42.39 -38.93 2.02 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.374 0.607 . . . . 0.0 110.267 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.652 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.3 OUTLIER -78.59 -67.58 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.272 178.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 44' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 10.0 mtt180 -32.26 -42.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 122.396 1.093 . . . . 0.0 110.35 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.922 HG22 ' HG2' ' A' ' 122' ' ' GLN . 92.5 t -73.04 -59.87 2.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 113.106 -1.861 . . . . 0.0 112.924 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.48 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 13.5 t -122.57 -52.79 1.91 Allowed 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.137 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.584 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 111.89 96.06 2.29 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.096 -177.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.665 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . -59.12 -133.53 0.01 OUTLIER Glycine 0 CA--C 1.523 0.581 0 C-N-CA 121.37 -0.443 . . . . 0.0 113.594 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.551 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 38.9 Cg_endo -85.79 104.29 0.77 Allowed 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.551 2.834 . . . . 0.0 114.781 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 51.51 -71.12 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 176.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.681 ' CH2' HG13 ' B' ' 39' ' ' VAL . 30.1 m95 73.23 4.64 4.93 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.058 0.543 . . . . 0.0 111.281 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 45.8 m -101.99 146.04 28.44 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.07 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -159.95 -57.21 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.185 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -81.95 39.1 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.987 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.371 -0.823 . . . . 0.0 111.275 -179.771 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.685 0.279 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 63.35 111.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.446 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -103.26 -122.45 0.19 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.983 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.668 HG23 ' H ' ' A' ' 110' ' ' ASN . 1.3 t -159.67 -57.74 0.06 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.373 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.668 ' H ' HG23 ' A' ' 109' ' ' THR . 17.3 m120 -157.05 85.32 2.9 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.339 179.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.631 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 39.5 Cg_endo -60.37 -8.46 8.71 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.516 2.144 . . . . 0.0 113.424 -177.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -90.34 -44.97 9.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.397 0.618 . . . . 0.0 110.157 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -79.83 -54.11 6.14 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.409 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.631 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -50.61 -32.06 17.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.144 -179.489 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.665 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 72.7 m -85.42 -34.66 21.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.568 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.591 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.0 t -51.11 -36.43 40.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.223 0.535 . . . . 0.0 109.602 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 75.6 mt -81.41 -59.0 2.79 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.245 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.8 m -101.59 -57.03 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.836 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.665 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 124.39 163.14 11.61 Favored Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.624 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.768 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -111.86 167.98 9.94 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.453 0.644 . . . . 0.0 111.432 179.802 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.699 ' O ' HD12 ' A' ' 125' ' ' LEU . 42.3 p -103.44 155.28 18.62 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 114.755 -1.111 . . . . 0.0 109.496 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.886 ' HG2' HG22 ' B' ' 45' ' ' VAL . 31.2 mt-30 -58.84 -5.75 0.66 Allowed 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.562 ' O ' HG23 ' A' ' 127' ' ' THR . 2.5 mp0 -88.42 -51.78 5.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.599 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t70 -55.01 -56.2 22.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.752 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.1 mt -56.01 -32.05 63.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.714 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 5.8 mt -62.7 -30.59 71.51 Favored 'General case' 0 CA--C 1.524 -0.053 0 CA-C-O 121.028 0.442 . . . . 0.0 110.191 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.562 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -96.42 -5.25 40.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.559 -179.725 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.9 mt -92.65 -21.29 20.11 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.992 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 30.3 p -66.94 153.29 94.65 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.764 179.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -78.18 6.07 4.96 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.16 2.573 . . . . 0.0 112.476 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.846 -179.999 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo . . . . . 0 N--CA 1.485 1.029 0 N-CA-C 111.145 -0.367 . . . . 0.0 111.145 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.44 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 14.9 p 61.92 133.21 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.602 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 84.5 Cg_endo -97.09 -157.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.972 0 C-N-CA 123.167 2.578 . . . . 0.0 111.76 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.512 ' HB3' ' NE2' ' A' ' 123' ' ' GLN . 2.8 pt-20 -80.92 76.35 7.86 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.587 0.708 . . . . 0.0 110.228 179.194 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 8.4 ttt -80.74 115.43 20.24 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.182 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -80.28 151.82 29.36 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.492 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 10.9 pt-20 -163.75 136.51 5.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.592 0.71 . . . . 0.0 110.936 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 82.0 mttt -55.54 117.5 3.64 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.322 -1.308 . . . . 0.0 112.478 -178.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.809 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 21.4 mt -116.93 100.91 8.08 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.183 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.591 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 83.2 m -95.79 76.78 3.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.27 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.34 -81.98 0.2 Allowed Glycine 0 C--O 1.229 -0.193 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.842 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.563 ' O ' ' HG3' ' B' ' 40' ' ' ARG . 11.3 t-160 -60.27 -53.41 57.99 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 117.285 0.542 . . . . 0.0 110.725 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.597 ' HA ' ' HE ' ' B' ' 40' ' ' ARG . 13.1 m-70 -52.58 -45.13 66.33 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.809 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 24.2 t80 -56.03 -29.36 60.3 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 113.104 -1.862 . . . . 0.0 109.85 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.704 ' O ' HG23 ' B' ' 43' ' ' VAL . 0.9 OUTLIER -73.09 -57.63 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.387 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.597 ' HE ' ' HA ' ' B' ' 37' ' ' HIS . 23.9 mtm180 -44.92 -66.7 0.36 Allowed 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.159 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.892 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.08 -46.5 61.8 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.669 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.82 -39.11 17.43 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.265 0.555 . . . . 0.0 109.792 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.718 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.7 OUTLIER -73.22 -65.03 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.95 178.238 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -34.94 -41.04 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.165 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.892 HG23 ' O ' ' B' ' 41' ' ' ALA . 66.5 t -74.46 -61.86 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 113.34 -1.755 . . . . 0.0 112.89 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 8.9 t -119.54 -54.58 2.16 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.368 -176.285 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.515 ' C ' ' HE1' ' B' ' 51' ' ' TRP . . . 142.45 -115.53 0.96 Allowed Glycine 0 C--N 1.318 -0.453 0 CA-C-N 114.61 -1.177 . . . . 0.0 111.719 -178.542 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.521 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 153.92 -142.57 9.25 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.627 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.592 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 97.7 Cg_endo -79.18 42.59 1.32 Allowed 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.888 2.392 . . . . 0.0 112.55 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 68.51 -25.55 0.14 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.718 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 11.4 m95 57.67 9.13 0.77 Allowed 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 178.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 52' ' ' SER . . . . . 0.497 ' O ' ' N ' ' B' ' 54' ' ' GLU . 64.6 m 53.6 -100.07 0.1 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.224 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 28.1 p 50.03 -79.8 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.628 0.58 . . . . 0.0 112.171 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' B' ' 52' ' ' SER . 20.0 mm-40 -81.66 28.83 0.39 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.14 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.356 -0.83 . . . . 0.0 111.028 179.89 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.7 0.286 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.26 150.39 23.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.941 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -106.34 -165.58 1.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.133 0.492 . . . . 0.0 111.475 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.477 HG23 ' N ' ' A' ' 110' ' ' ASN . 15.3 t -76.4 -145.54 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.488 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.477 ' N ' HG23 ' A' ' 109' ' ' THR . 2.5 m-20 -79.34 119.22 76.29 Favored Pre-proline 0 C--N 1.331 -0.21 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.624 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 60.9 Cg_endo -69.69 -10.31 28.29 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.329 2.019 . . . . 0.0 113.021 -179.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.47 -43.8 8.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.098 0.475 . . . . 0.0 111.336 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -77.1 -48.41 17.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.926 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.624 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -55.22 -30.58 60.27 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.095 -179.248 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.673 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 70.7 m -84.01 -29.0 27.3 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.19 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.601 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 51.4 t -54.94 -42.73 72.67 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.407 ' O ' ' HE2' ' B' ' 32' ' ' LYS . 12.0 mt -81.51 -46.48 14.43 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.926 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.0 m -102.92 -74.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.1 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.673 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 135.1 156.93 7.84 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.589 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.946 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -108.46 168.07 9.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.522 0.677 . . . . 0.0 111.765 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.754 ' O ' HD12 ' A' ' 125' ' ' LEU . 26.9 p -107.69 158.67 17.08 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.696 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.848 ' HG2' HG22 ' B' ' 45' ' ' VAL . 30.4 mt-30 -62.57 -2.38 1.07 Allowed 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.001 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.717 ' O ' HG23 ' A' ' 127' ' ' THR . 97.0 mt-30 -90.65 -57.07 2.95 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 176.06 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.537 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.5 OUTLIER -54.44 -53.39 54.82 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.304 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.754 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mt -56.05 -36.37 67.96 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.789 178.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' B' ' 46' ' ' CYS . 5.6 mt -62.27 -31.06 71.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 120.974 0.416 . . . . 0.0 109.942 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.717 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -90.19 -7.72 52.91 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.47 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.604 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.4 mt -94.99 -13.56 25.16 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.148 0.499 . . . . 0.0 109.984 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.418 ' SG ' ' CD ' ' A' ' 130' ' ' PRO . 1.6 t -51.64 157.25 1.93 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.917 178.096 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.418 ' CD ' ' SG ' ' A' ' 129' ' ' CYS . 2.4 Cg_endo -84.45 9.84 3.97 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 123.407 2.738 . . . . 0.0 112.087 -179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.815 179.928 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 25' ' ' PRO . . . . . 0.472 ' O ' HG23 ' B' ' 26' ' ' THR . 1.9 Cg_endo . . . . . 0 N--CA 1.484 0.93 0 N-CA-C 111.034 -0.41 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.472 HG23 ' O ' ' B' ' 25' ' ' PRO . 0.8 OUTLIER -162.61 148.53 10.21 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.923 -179.902 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -89.57 85.95 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.834 2.356 . . . . 0.0 112.352 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 34.98 52.19 0.59 Allowed 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 121.611 0.72 . . . . 0.0 111.961 -179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.5 tpt -76.73 110.37 11.26 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.202 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -75.43 125.89 29.9 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.397 -1.274 . . . . 0.0 111.661 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.0 pt-20 -137.42 144.65 42.48 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.515 0.674 . . . . 0.0 110.846 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 4.6 mtpm? -60.4 106.58 0.55 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.394 -1.276 . . . . 0.0 112.421 -177.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.946 HD12 ' SG ' ' A' ' 120' ' ' CYS . 60.1 mt -106.14 98.19 7.91 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.945 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.601 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.6 m -93.22 71.05 4.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.214 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.7 -75.18 0.57 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.443 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.549 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 7.8 t-160 -64.27 -51.35 63.98 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 117.133 0.466 . . . . 0.0 110.569 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.574 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 13.2 m-70 -56.13 -39.18 71.85 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.783 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 38.4 t80 -63.46 -26.4 68.71 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.216 179.113 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.697 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.6 t -74.57 -67.28 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.79 176.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.582 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.7 OUTLIER -45.37 -58.47 3.3 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.207 0.317 . . . . 0.0 110.51 178.898 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.929 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.1 -51.86 39.5 Favored 'General case' 0 C--O 1.214 -0.81 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.58 -44.67 8.98 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.313 0.578 . . . . 0.0 110.465 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.695 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -69.34 -62.65 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.898 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -35.56 -39.83 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.849 -1.068 . . . . 0.0 109.684 177.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.929 HG23 ' O ' ' B' ' 41' ' ' ALA . 57.3 t -74.13 -58.19 5.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.904 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.608 ' HB2' HD23 ' A' ' 126' ' ' LEU . 39.5 t -129.27 -64.91 0.88 Allowed 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.853 -177.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.526 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 161.25 -118.82 0.85 Allowed Glycine 0 N--CA 1.45 -0.43 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.433 -178.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.55 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 157.62 -141.7 7.99 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.301 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.567 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 92.5 Cg_endo -79.01 43.4 1.47 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.84 2.36 . . . . 0.0 112.433 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 68.47 -26.69 0.14 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.232 0.613 . . . . 0.0 112.555 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.697 ' CH2' HG13 ' B' ' 39' ' ' VAL . 9.5 m95 58.29 9.22 0.96 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 6.3 m -126.3 -165.46 1.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.337 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 72.1 p 48.95 87.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.152 0.501 . . . . 0.0 111.156 -179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 41.55 85.17 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.622 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.116 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.788 0.328 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.97 120.76 15.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.154 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.402 ' O ' ' C ' ' A' ' 109' ' ' THR . . . -105.72 125.09 50.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.213 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.467 HG23 ' N ' ' A' ' 110' ' ' ASN . 9.1 t 34.15 -129.6 0.07 Allowed 'General case' 0 CA--C 1.53 0.209 0 O-C-N 123.622 0.576 . . . . 0.0 111.073 179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.467 ' N ' HG23 ' A' ' 109' ' ' THR . 15.8 m120 -88.61 104.08 6.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.548 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 72.8 Cg_endo -69.89 -13.0 33.75 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.299 1.999 . . . . 0.0 112.781 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.38 -44.94 8.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.539 -179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.9 mmt180 -77.38 -45.29 26.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.954 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.548 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -58.13 -28.49 64.72 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.956 -179.16 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.737 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 98.7 m -84.68 -24.09 29.12 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.9 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.646 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.6 t -60.57 -45.18 94.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.96 -40.84 23.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.498 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.8 t -101.68 -78.45 0.53 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.391 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.737 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.2 147.35 6.32 Favored Glycine 0 C--O 1.228 -0.261 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.732 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 1.023 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -109.85 142.4 41.2 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.081 0.467 . . . . 0.0 110.86 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.762 HG23 ' HG2' ' B' ' 30' ' ' ARG . 10.7 p -72.01 -91.12 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 122.333 1.063 . . . . 0.0 111.453 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.894 ' HG2' HG22 ' B' ' 45' ' ' VAL . 24.3 mt-30 -156.28 -30.64 0.09 Allowed 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.986 -1.915 . . . . 0.0 108.546 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.691 ' O ' HG23 ' A' ' 127' ' ' THR . 49.3 mt-30 -63.66 -49.08 74.61 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.16 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.55 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 31.5 t70 -57.05 -56.46 21.44 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.643 HD21 HD13 ' B' ' 33' ' ' LEU . 1.1 mt -58.3 -25.33 61.73 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.76 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.44 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 11.2 mt -71.77 -30.87 66.04 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.874 0.369 . . . . 0.0 110.338 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -92.1 -7.28 49.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.232 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 24.1 mt -95.48 -22.76 17.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.763 0.316 . . . . 0.0 110.919 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 17.4 p -69.45 164.81 46.22 Favored Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.511 178.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_exo -72.76 159.98 47.26 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.709 2.272 . . . . 0.0 111.865 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.049 -179.781 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo . . . . . 0 N--CA 1.485 0.994 0 N-CA-C 110.991 -0.427 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 56.1 p -72.9 135.46 80.51 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.269 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 72.3 Cg_endo -95.59 -159.05 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.001 2.467 . . . . 0.0 111.527 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.682 ' HB2' HG21 ' A' ' 121' ' ' THR . 4.9 pt-20 -81.48 74.22 8.49 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.793 0.806 . . . . 0.0 110.047 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.2 tpt -85.1 112.0 20.27 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.248 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.762 ' HG2' HG23 ' A' ' 121' ' ' THR . 13.7 mtt180 -76.4 110.16 10.7 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.718 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.61 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 10.1 tp10 -115.23 142.45 46.66 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.303 0.573 . . . . 0.0 111.713 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 76.7 mttt -63.27 102.23 0.38 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.912 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 1.023 HD12 ' SG ' ' A' ' 120' ' ' CYS . 60.4 mt -101.16 102.37 13.28 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.911 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.646 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.3 t -97.84 76.0 2.42 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.412 0.625 . . . . 0.0 111.355 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.435 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.35 -73.91 0.56 Allowed Glycine 0 C--N 1.319 -0.416 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.678 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.486 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 1.1 t60 -67.73 -52.86 32.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 117.142 0.471 . . . . 0.0 111.002 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.526 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.7 m170 -54.58 -36.22 64.15 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 176.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.785 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 41.7 t80 -66.67 -29.62 69.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 112.96 -1.927 . . . . 0.0 109.517 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.675 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.9 t -71.88 -68.25 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.305 -0.861 . . . . 0.0 108.694 177.312 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.573 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -45.53 -56.7 4.81 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 119.523 -0.275 . . . . 0.0 110.316 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.87 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.31 -51.61 52.72 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.078 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.65 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.14 -46.53 5.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.413 0.625 . . . . 0.0 110.303 179.852 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.686 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -68.76 -64.71 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.179 179.101 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -34.08 -41.64 0.11 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.249 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.894 HG22 ' HG2' ' A' ' 122' ' ' GLN . 71.5 t -74.26 -60.22 2.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 113.304 -1.771 . . . . 0.0 112.682 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 t -123.69 -59.58 1.52 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.522 -176.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.518 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 152.29 -113.12 0.56 Allowed Glycine 0 N--CA 1.452 -0.266 0 CA-C-N 114.775 -1.102 . . . . 0.0 112.359 -178.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.492 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 150.33 -144.14 11.54 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.429 -0.891 . . . . 0.0 112.606 -179.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.581 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 86.8 Cg_endo -81.34 45.76 2.07 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.882 2.388 . . . . 0.0 112.604 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 68.23 -27.55 0.14 Allowed 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.686 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 17.1 m95 58.43 10.29 1.3 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 52' ' ' SER . . . . . 0.47 ' O ' ' N ' ' B' ' 54' ' ' GLU . 4.0 m -109.98 -173.5 2.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.966 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 69.4 p 53.01 -79.03 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.86 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' GLU . . . . . 0.47 ' N ' ' O ' ' B' ' 52' ' ' SER . 26.9 tt0 -159.08 134.91 8.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.6 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.084 179.921 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.774 0.321 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -144.74 -16.63 0.53 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.046 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.85 -168.18 1.41 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.103 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.613 HG23 ' HB2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -76.46 -84.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.305 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.499 ' H ' HG23 ' A' ' 109' ' ' THR . 2.2 m120 -156.28 97.49 2.21 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.275 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 19.3 Cg_endo -56.4 90.26 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.089 1.859 . . . . 0.0 111.536 -179.217 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 159.46 -64.24 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 114.387 -1.279 . . . . 0.0 107.867 -179.185 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 2.3 mpp_? -77.29 -20.96 54.29 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.613 ' HB2' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -65.4 -41.68 93.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.981 179.028 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.6 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 2.2 m -92.72 -22.65 19.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.09 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.603 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.1 t -65.02 -36.26 83.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.913 0.387 . . . . 0.0 110.516 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.68 -46.34 15.73 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.856 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 31.7 m -117.37 -44.64 2.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.501 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 119.84 163.72 12.34 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.557 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.617 ' HB2' HD12 ' B' ' 33' ' ' LEU . 81.9 m -134.08 139.04 45.7 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.354 0.597 . . . . 0.0 112.321 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.822 HG23 ' HG3' ' B' ' 30' ' ' ARG . 58.8 p -75.41 154.01 37.37 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.695 179.29 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.759 ' HG2' HG22 ' B' ' 45' ' ' VAL . 34.5 mt-30 -53.38 -19.9 3.95 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.592 ' O ' HG23 ' A' ' 127' ' ' THR . 6.8 mm100 -68.98 -52.77 25.48 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.539 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.24 -54.01 48.79 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.392 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.763 HD12 ' O ' ' A' ' 121' ' ' THR . 1.4 mp -59.55 -29.87 68.22 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.451 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.562 ' HG ' HG13 ' B' ' 45' ' ' VAL . 7.5 mt -64.04 -29.97 71.07 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 178.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -101.36 -0.28 35.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.408 -179.882 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.667 HD12 ' HA ' ' A' ' 125' ' ' LEU . 52.0 mt -92.01 -23.58 19.48 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.667 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 18.4 p -71.19 156.88 91.26 Favored Pre-proline 0 C--O 1.232 0.147 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.69 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 2.3 Cg_endo -82.66 15.06 2.13 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.136 2.557 . . . . 0.0 112.736 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.904 179.944 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo . . . . . 0 N--CA 1.482 0.823 0 N-CA-C 111.195 -0.348 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 74.1 p -73.28 133.28 81.1 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.991 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -95.41 67.43 0.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.945 2.43 . . . . 0.0 112.129 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 28' ' ' GLU . . . . . 0.551 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 8.8 pt-20 36.53 73.24 0.09 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.839 0.828 . . . . 0.0 111.333 -178.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 43.0 ttm -82.35 13.69 3.42 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.086 -179.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.822 ' HG3' HG23 ' A' ' 121' ' ' THR . 0.1 OUTLIER 34.14 96.37 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.184 -0.916 . . . . 0.0 113.157 178.734 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.459 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.6 pt-20 -119.56 156.74 29.76 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.104 0.478 . . . . 0.0 110.252 178.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -61.31 108.15 0.88 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.179 -0.919 . . . . 0.0 113.168 -177.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.753 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.3 mt -103.87 96.8 6.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.896 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.603 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 5.0 t -96.27 90.56 5.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.36 0.6 . . . . 0.0 111.254 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.428 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.71 -78.71 0.02 OUTLIER Glycine 0 C--N 1.321 -0.255 0 CA-C-N 114.849 -1.069 . . . . 0.0 112.973 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.479 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 3.5 t-160 -66.06 -52.62 47.29 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.449 0.624 . . . . 0.0 111.215 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.475 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 4.4 m-70 -55.82 -35.64 66.57 Favored 'General case' 0 CA--C 1.501 -0.906 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 177.067 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.753 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 28.2 t80 -68.86 -26.73 65.29 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 112.962 -1.926 . . . . 0.0 109.433 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.638 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.4 t -74.17 -67.12 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.852 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.585 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.6 mpt_? -44.74 -61.6 1.52 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.627 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.791 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -49.43 -45.76 46.86 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 119.861 -0.735 . . . . 0.0 109.548 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.644 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.3 OUTLIER -49.78 -41.16 43.65 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.065 0.46 . . . . 0.0 110.346 179.507 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.716 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -75.79 -61.67 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.292 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 44' ' ' ARG . . . . . 0.421 ' C ' ' O ' ' B' ' 43' ' ' VAL . 5.2 mtt180 -33.19 -41.48 0.07 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.547 1.165 . . . . 0.0 108.853 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.791 HG23 ' O ' ' B' ' 41' ' ' ALA . 82.5 t -74.99 -68.57 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-N 112.871 -1.968 . . . . 0.0 112.621 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 8.5 t -127.77 -60.44 1.16 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.866 -175.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.716 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 110.86 95.72 2.32 Favored Glycine 0 N--CA 1.453 -0.172 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.956 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.69 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . -50.88 -97.99 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.376 -0.44 . . . . 0.0 113.125 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.558 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 19.2 Cg_endo -89.83 175.16 3.14 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 124.573 3.515 . . . . 0.0 111.094 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -81.9 112.8 19.34 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.899 1.333 . . . . 0.0 109.54 178.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.679 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 9.9 m95 -72.82 -77.78 0.1 Allowed 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 112.184 -2.28 . . . . 0.0 113.294 -177.352 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 22.2 m -152.42 132.43 13.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.116 0.484 . . . . 0.0 111.93 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.9 p -155.69 77.07 0.96 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.277 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -82.54 -2.26 53.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.015 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.313 179.993 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.736 0.303 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.69 4.96 52.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.124 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -131.75 -160.81 1.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.082 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.602 HG23 ' H ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -75.07 -85.82 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.247 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.602 ' H ' HG23 ' A' ' 109' ' ' THR . 15.3 m120 -153.21 86.7 4.03 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.541 ' HG3' HD22 ' A' ' 128' ' ' LEU . 28.0 Cg_endo -57.58 -4.46 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.869 2.379 . . . . 0.0 113.795 -177.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.404 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -88.2 -49.62 6.88 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.486 0.66 . . . . 0.0 109.722 178.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -78.77 -26.24 44.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.182 178.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.485 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -70.54 -55.25 9.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.966 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.581 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 10.0 m -68.89 -24.4 64.32 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.242 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.626 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 38.0 t -61.3 -52.89 62.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.813 0.339 . . . . 0.0 111.15 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.0 mt -79.2 -34.72 42.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.056 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 m -106.4 -59.88 1.73 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.567 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.72 162.14 11.65 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.469 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.2 m -143.02 147.09 34.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.799 0.799 . . . . 0.0 112.882 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.829 ' O ' HD12 ' A' ' 125' ' ' LEU . 29.5 p -87.64 169.78 11.84 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.005 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.904 ' HG2' HG22 ' B' ' 45' ' ' VAL . 28.5 mt-30 -66.63 3.46 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.368 178.171 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.722 ' O ' HG23 ' A' ' 127' ' ' THR . 96.0 mt-30 -94.31 -54.83 3.4 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.57 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -56.33 -53.4 57.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.574 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.829 HD12 ' O ' ' A' ' 121' ' ' THR . 1.0 OUTLIER -56.75 -33.09 66.23 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.32 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.495 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.7 mt -66.78 -35.52 80.28 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.067 0.46 . . . . 0.0 110.033 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.722 HG23 ' O ' ' A' ' 123' ' ' GLN . 5.3 p -82.97 -5.89 59.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.463 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 125' ' ' LEU . 50.3 mt -92.84 -70.8 0.68 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.823 -179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.68 ' H ' HD21 ' B' ' 42' ' ' LEU . 0.0 OUTLIER 47.19 -172.5 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.883 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.606 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 1.3 Cg_endo -80.11 141.5 14.74 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.755 1.637 . . . . 0.0 112.35 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.187 179.69 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.484 0.953 0 N-CA-C 111.179 -0.354 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.401 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 3.9 t -166.18 143.44 4.4 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.115 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 85.0 Cg_endo -97.31 -157.72 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.331 2.687 . . . . 0.0 111.917 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -81.24 75.63 8.2 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.599 0.714 . . . . 0.0 110.241 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.05 119.77 23.95 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.168 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.559 ' NE ' HG23 ' A' ' 121' ' ' THR . 17.3 mmt180 -77.54 120.2 22.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.245 -0.888 . . . . 0.0 111.118 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.649 ' HG3' HD21 ' B' ' 33' ' ' LEU . 10.3 pt-20 -133.1 143.86 49.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.321 0.582 . . . . 0.0 110.466 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 78.0 mttt -62.93 113.27 2.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.862 -1.063 . . . . 0.0 113.22 -177.48 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.778 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 6.7 mt -110.19 99.7 8.72 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.842 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.626 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.9 OUTLIER -99.03 95.32 7.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.298 0.57 . . . . 0.0 111.354 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 59.95 -82.42 0.01 OUTLIER Glycine 0 C--N 1.321 -0.254 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.18 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.491 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.0 t-160 -66.21 -51.64 55.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.273 0.536 . . . . 0.0 111.501 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.427 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -54.0 -39.7 66.3 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 176.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.778 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 22.4 t80 -64.39 -28.91 70.01 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 112.692 -2.049 . . . . 0.0 109.597 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.681 HG13 ' CH2' ' B' ' 51' ' ' TRP . 2.2 t -72.58 -69.74 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.546 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.8 OUTLIER -41.06 -57.57 2.0 Allowed 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 123.382 0.426 . . . . 0.0 111.258 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.871 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -55.44 -50.24 70.33 Favored 'General case' 0 C--O 1.21 -0.987 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.408 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.706 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -46.5 -35.91 6.18 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.271 0.558 . . . . 0.0 110.749 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.748 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.5 OUTLIER -77.51 -61.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.849 178.998 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 3.6 mmm180 -37.29 -40.37 0.34 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 122.622 1.201 . . . . 0.0 109.493 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.904 HG22 ' HG2' ' A' ' 122' ' ' GLN . 47.4 t -79.31 -71.22 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 112.607 -2.088 . . . . 0.0 114.108 -178.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 5.6 t -101.44 -26.01 13.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.789 -176.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.427 ' O ' ' C ' ' B' ' 48' ' ' GLY . . . 84.02 13.49 74.47 Favored Glycine 0 C--N 1.318 -0.449 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -178.302 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.606 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . 27.24 -133.97 0.03 OUTLIER Glycine 0 C--N 1.34 0.775 0 O-C-N 124.413 0.713 . . . . 0.0 113.094 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.573 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 60.5 Cg_endo -70.6 -144.13 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.512 2.141 . . . . 0.0 110.345 178.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 50' ' ' ARG . . . . . 0.531 ' HE ' ' HB2' ' B' ' 52' ' ' SER . 6.8 ptm180 -89.68 -28.92 19.12 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.748 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 45.5 m95 63.2 10.04 4.35 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.251 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 52' ' ' SER . . . . . 0.531 ' HB2' ' HE ' ' B' ' 50' ' ' ARG . 51.1 m -89.89 -10.45 45.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.009 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 55.2 p -81.38 90.1 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.131 0.491 . . . . 0.0 111.027 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 46.78 86.38 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.195 -0.912 . . . . 0.0 111.37 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.156 -0.926 . . . . 0.0 111.056 -179.837 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.824 0.345 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -164.69 35.69 0.07 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.157 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.4 28.75 7.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.179 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 6.1 t 40.74 58.54 2.4 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.271 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.47 ' HB2' ' HB2' ' A' ' 113' ' ' ARG . 2.5 m-20 47.61 94.36 0.05 OUTLIER Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.44 -178.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.412 ' HA ' ' HD2' ' A' ' 114' ' ' TYR . 27.1 Cg_endo -59.16 -4.62 2.32 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.092 1.861 . . . . 0.0 112.237 -179.244 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -98.96 -41.14 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.211 0.529 . . . . 0.0 110.581 179.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.47 ' HB2' ' HB2' ' A' ' 110' ' ' ASN . 27.4 mmt180 -77.59 -36.62 51.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.833 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.463 ' CZ ' ' SG ' ' A' ' 120' ' ' CYS . 0.0 OUTLIER -65.54 -36.92 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.365 -179.494 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.568 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 13.5 m -83.15 -22.85 33.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.21 178.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.597 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 40.6 t -61.35 -54.04 48.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.315 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.5 mt -79.3 -32.51 43.53 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 70.7 m -105.5 -61.61 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.476 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 121.13 154.12 9.19 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 -178.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.608 ' HB3' ' HB3' ' A' ' 124' ' ' ASP . 92.1 m -133.78 139.58 46.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.779 ' O ' HD12 ' A' ' 125' ' ' LEU . 43.2 p -73.99 160.36 31.43 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.868 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.874 ' HG2' HG22 ' B' ' 45' ' ' VAL . 18.5 mt-30 -57.61 -16.98 12.01 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.644 ' O ' HG23 ' A' ' 127' ' ' THR . 6.3 mt-30 -70.55 -52.11 23.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.608 ' HB3' ' HB3' ' A' ' 120' ' ' CYS . 7.9 t70 -54.0 -54.36 40.11 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.808 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -58.82 -31.14 68.2 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.776 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.6 mt -64.79 -27.6 69.0 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 109.895 178.417 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.644 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -91.45 -16.46 27.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.291 -179.821 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 17.1 mt -95.91 -4.61 43.2 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.339 0.59 . . . . 0.0 109.865 -179.529 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.561 ' N ' ' CD ' ' A' ' 130' ' ' PRO . 15.8 t -58.7 -44.89 99.53 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.65 179.061 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 129' ' ' CYS . 72.5 Cg_endo -87.0 12.07 3.08 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.726 2.951 . . . . 0.0 112.771 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.188 -0.91 . . . . 0.0 110.836 179.864 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 25' ' ' PRO . . . . . 0.489 ' O ' HG23 ' B' ' 26' ' ' THR . 1.6 Cg_endo . . . . . 0 N--CA 1.482 0.848 0 N-CA-C 111.181 -0.353 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.489 HG23 ' O ' ' B' ' 25' ' ' PRO . 1.4 p -161.27 143.46 9.07 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.802 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 88.1 Cg_endo -97.97 58.68 0.08 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 123.286 2.657 . . . . 0.0 111.897 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 37.68 69.61 0.23 Allowed 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.049 -178.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.8 tpt -75.83 116.07 16.16 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.427 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' ARG . . . . . 0.49 ' HE ' HG23 ' A' ' 121' ' ' THR . 8.7 mtt180 -75.29 165.74 24.71 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.965 -178.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.531 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 6.4 tp10 -169.73 140.73 2.18 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.36 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.8 103.63 1.16 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.301 -179.168 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.783 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 26.9 mt -98.67 97.1 8.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.713 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.597 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.2 m -95.48 78.13 3.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.297 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.05 -80.49 0.19 Allowed Glycine 0 C--O 1.228 -0.23 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.541 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.485 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 9.2 t-160 -60.3 -55.89 28.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 117.083 0.441 . . . . 0.0 110.696 179.128 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.54 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 14.5 m-70 -51.83 -43.81 63.3 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.173 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.783 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.9 t80 -60.08 -27.99 67.44 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.993 -1.912 . . . . 0.0 110.067 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.711 HG13 ' CH2' ' B' ' 51' ' ' TRP . 0.9 OUTLIER -73.11 -62.46 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.307 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.566 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.6 OUTLIER -48.27 -64.14 0.88 Allowed 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.704 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.836 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -47.16 -44.06 21.56 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.105 -0.638 . . . . 0.0 109.782 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.638 ' N ' HD22 ' A' ' 125' ' ' LEU . 0.5 OUTLIER -50.49 -45.22 56.27 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-O 121.451 0.643 . . . . 0.0 110.137 179.622 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.72 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -72.85 -60.62 2.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.129 179.055 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.6 mtt180 -34.66 -41.6 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 122.264 1.03 . . . . 0.0 109.123 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.874 HG22 ' HG2' ' A' ' 122' ' ' GLN . 70.6 t -72.44 -61.1 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.84 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 46' ' ' CYS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 129' ' ' CYS . 34.8 t -138.8 -61.02 0.58 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.679 -176.417 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.582 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 167.51 -117.41 0.73 Allowed Glycine 0 N--CA 1.445 -0.704 0 CA-C-N 114.736 -1.12 . . . . 0.0 112.485 -178.182 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.615 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 162.4 -134.19 3.38 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.198 -179.35 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.507 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 91.0 Cg_endo -78.41 41.56 1.07 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.944 2.429 . . . . 0.0 112.331 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 50' ' ' ARG . . . . . 0.412 ' C ' ' CD1' ' B' ' 51' ' ' TRP . 2.6 mmp_? 69.39 -30.13 0.19 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.252 0.621 . . . . 0.0 112.504 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.72 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 9.3 m95 64.11 -71.19 0.07 Allowed 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.097 0.475 . . . . 0.0 111.967 179.042 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 73.9 m -145.68 -104.9 0.1 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.533 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 58.2 p 40.63 73.8 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.469 0.652 . . . . 0.0 111.737 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -84.08 24.69 0.9 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.131 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.033 -179.985 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.862 0.363 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -151.09 -20.36 0.21 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.296 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -110.62 105.96 15.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.381 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.436 HG23 ' H ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER 33.6 -94.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.211 179.787 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.436 ' H ' HG23 ' A' ' 109' ' ' THR . 15.8 m120 -152.51 93.15 3.34 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.614 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 55.8 Cg_endo -65.81 -8.25 19.09 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.44 2.094 . . . . 0.0 113.075 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.27 -41.3 11.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.244 0.545 . . . . 0.0 110.606 179.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -79.77 -49.89 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.792 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.614 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -53.84 -31.63 50.08 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.965 -179.11 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.699 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 65.0 m -81.53 -34.35 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.446 -0.501 . . . . 0.0 111.828 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.632 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 48.0 t -56.18 -34.64 66.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 98.6 mt -81.6 -55.66 4.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.281 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 16.0 p -104.7 -53.32 2.71 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.994 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.699 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 118.62 162.87 12.31 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.913 -0.661 . . . . 0.0 111.926 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' CYS . . . . . 0.84 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -117.4 157.28 26.47 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.545 0.688 . . . . 0.0 111.878 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.636 ' O ' HD12 ' A' ' 125' ' ' LEU . 58.3 p -93.69 159.64 15.12 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.526 178.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.876 ' HG2' HG22 ' B' ' 45' ' ' VAL . 26.3 mt-30 -65.37 6.1 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.73 ' O ' HG23 ' A' ' 127' ' ' THR . 56.8 mt-30 -98.26 -53.65 3.29 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 175.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.544 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 3.4 m-20 -56.73 -53.98 51.54 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.727 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.2 mt -56.2 -32.54 64.47 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.901 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.498 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.3 mt -67.29 -37.59 83.66 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' THR . . . . . 0.73 HG23 ' O ' ' A' ' 123' ' ' GLN . 7.0 p -79.17 -5.9 55.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 125' ' ' LEU . 71.0 mt -91.24 -74.79 0.49 Allowed 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.565 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' CYS . . . . . 0.728 ' H ' HD21 ' B' ' 42' ' ' LEU . 0.1 OUTLIER 46.28 -174.67 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 179.973 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.488 ' HD3' ' SG ' ' A' ' 129' ' ' CYS . 13.6 Cg_exo -71.08 -9.12 25.0 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.811 1.674 . . . . 0.0 112.106 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.965 -179.8 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 25' ' ' PRO . . . . . 0.5 ' O ' HG23 ' B' ' 26' ' ' THR . 9.8 Cg_endo . . . . . 0 N--CA 1.485 1.017 0 N-CA-C 111.028 -0.412 . . . . 0.0 111.028 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.5 HG23 ' O ' ' B' ' 25' ' ' PRO . 2.2 p -161.07 126.81 2.3 Favored Pre-proline 0 CA--C 1.531 0.216 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.012 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -99.44 -156.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.564 2.843 . . . . 0.0 111.534 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -80.98 77.56 7.87 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 121.512 0.672 . . . . 0.0 109.833 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 6.6 ttp -78.66 114.64 17.76 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.197 -179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 8.3 mtt180 -78.37 172.29 13.83 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.3 -1.318 . . . . 0.0 112.042 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.9 tp10 -170.94 131.37 0.82 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.604 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 70.2 mttt -63.75 110.4 2.04 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.739 -178.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.84 HD12 ' SG ' ' A' ' 120' ' ' CYS . 25.6 mt -107.82 108.36 19.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.403 -1.271 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 34' ' ' CYS . . . . . 0.632 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -102.1 77.84 1.72 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.396 0.617 . . . . 0.0 111.06 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.494 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 71.17 -79.9 0.5 Allowed Glycine 0 C--N 1.318 -0.47 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.994 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.517 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 6.1 t-160 -64.37 -51.95 60.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 117.43 0.615 . . . . 0.0 110.981 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 37' ' ' HIS . . . . . 0.418 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.8 m170 -54.58 -37.06 65.07 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.807 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.1 t80 -64.9 -27.99 69.23 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 113.095 -1.866 . . . . 0.0 109.736 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.667 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.7 t -73.63 -64.71 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.517 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.1 mpt_? -44.26 -59.88 2.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 123.37 0.419 . . . . 0.0 111.456 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.924 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -54.09 -46.18 71.99 Favored 'General case' 0 C--O 1.21 -0.974 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.728 HD21 ' H ' ' A' ' 129' ' ' CYS . 0.4 OUTLIER -47.87 -37.9 15.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.479 0.657 . . . . 0.0 110.076 -179.888 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 43' ' ' VAL . . . . . 0.676 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.6 OUTLIER -75.32 -60.45 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.071 178.902 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 44' ' ' ARG . . . . . 0.485 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.6 mtt180 -39.1 -37.54 0.39 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.333 1.063 . . . . 0.0 109.323 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.924 HG23 ' O ' ' B' ' 41' ' ' ALA . 59.2 t -79.31 -70.78 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 113.223 -1.808 . . . . 0.0 113.894 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.0 t -99.92 -29.74 12.4 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.773 -176.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' B' ' 43' ' ' VAL . . . 91.82 11.79 59.97 Favored Glycine 0 C--N 1.318 -0.437 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.603 -178.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.521 ' CA ' ' HE1' ' B' ' 51' ' ' TRP . . . 39.1 -141.89 0.49 Allowed Glycine 0 CA--C 1.52 0.359 0 O-C-N 123.717 0.304 . . . . 0.0 113.73 179.294 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.616 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 59.9 Cg_endo -71.3 -68.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.071 2.514 . . . . 0.0 114.025 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 50' ' ' ARG . . . . . 0.429 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 82.1 mtm180 -156.29 -41.11 0.08 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.579 -178.694 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 51' ' ' TRP . . . . . 0.676 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 14.5 m95 60.8 8.42 1.81 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.993 179.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 52' ' ' SER . . . . . 0.463 ' O ' ' N ' ' B' ' 54' ' ' GLU . 70.0 m -64.99 -67.13 0.46 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.698 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 67.9 p 53.88 -77.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.934 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 54' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' B' ' 52' ' ' SER . 40.2 mt-10 -81.08 9.7 6.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.746 0.308 . . . . 0.0 110.888 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.236 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.46 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.52 -0.179 0 CA-C-O 121.164 0.507 . . . . 0.0 110.999 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -77.62 -48.77 16.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.855 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.465 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.91 -46.41 71.44 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.138 -179.468 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -74.55 -24.44 58.94 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.802 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.55 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.9 t -63.14 -40.55 97.9 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.787 0.327 . . . . 0.0 110.999 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.4 mt -80.9 -45.0 17.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.821 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 32.5 t -108.31 -53.89 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.462 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 126.03 167.86 12.54 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.621 -179.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.783 ' HB2' HD12 ' B' ' 33' ' ' LEU . 68.1 m -140.64 138.73 34.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.799 ' O ' HD12 ' A' ' 125' ' ' LEU . 82.0 p -81.24 160.2 24.34 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.376 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.908 ' HG2' HG22 ' B' ' 45' ' ' VAL . 7.2 mt-30 -54.31 -17.64 3.18 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.635 ' O ' HG23 ' A' ' 127' ' ' THR . 44.9 mt-30 -71.27 -55.92 7.08 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.598 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -53.01 -56.01 19.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.866 -0.791 . . . . 0.0 108.866 178.435 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mp -57.95 -32.18 67.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.028 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 126' ' ' LEU . 7.0 mt -63.99 -28.3 69.71 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 120.837 0.351 . . . . 0.0 110.24 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.635 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -102.0 -2.6 29.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.722 -179.618 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 59.0 mt . . . . . 0 N--CA 1.45 -0.475 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.379 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.435 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.6 pt-20 . . . . . 0 CA--C 1.512 -0.511 0 CA-C-O 121.499 0.666 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -62.6 107.09 0.88 Allowed 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.676 -177.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.783 HD12 ' HB2' ' A' ' 120' ' ' CYS . 24.6 mt -97.59 95.74 7.82 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.692 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.55 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 33.9 m -92.31 85.96 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.576 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.88 -78.41 0.01 OUTLIER Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.776 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.498 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 5.9 t-160 -63.5 -54.18 40.41 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 117.074 0.437 . . . . 0.0 111.161 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 12.0 m-70 -52.37 -42.84 64.31 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 176.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.744 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 35.1 t80 -62.84 -28.81 70.28 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 112.579 -2.1 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.617 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.5 t -71.85 -66.9 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.538 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.9 OUTLIER -46.15 -59.12 3.08 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 119.374 -0.346 . . . . 0.0 110.641 178.844 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.821 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.3 -49.5 61.16 Favored 'General case' 0 C--O 1.213 -0.864 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.249 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.682 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.47 -38.62 4.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.381 0.61 . . . . 0.0 110.035 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -78.05 -65.7 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.332 179.345 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 6.1 mtt180 -32.87 -42.42 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 122.473 1.13 . . . . 0.0 109.94 177.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.908 HG22 ' HG2' ' A' ' 122' ' ' GLN . 58.8 t -74.67 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.105 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.3 t . . . . . 0 CA--C 1.514 -0.436 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.631 -176.179 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.41 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.248 0.547 . . . . 0.0 109.905 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.46 -24.3 56.95 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.491 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.472 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -62.89 -58.16 8.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.184 179.185 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.633 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -71.85 -29.61 64.57 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.437 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.637 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -57.45 -34.86 69.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.006 0.431 . . . . 0.0 110.479 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.9 mt -79.58 -59.67 2.65 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.891 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.3 m -105.14 -39.45 6.2 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 113.0 157.59 12.87 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.418 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.449 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.1 m -127.69 148.12 50.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.26 0.553 . . . . 0.0 112.424 -179.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.833 ' O ' HD12 ' A' ' 125' ' ' LEU . 12.5 p -84.76 165.7 17.59 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.334 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.868 ' HG2' HG22 ' B' ' 45' ' ' VAL . 11.1 mt-30 -65.27 0.09 1.56 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.408 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.609 ' O ' HG23 ' A' ' 127' ' ' THR . 23.4 mt-30 -92.06 -53.49 4.23 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.593 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.64 -54.22 46.83 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.374 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.833 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -57.47 -33.19 67.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.487 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.438 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.5 mt -62.85 -28.31 69.94 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.996 0.427 . . . . 0.0 110.205 178.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.609 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -98.07 -4.29 36.23 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.382 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 50.8 mt . . . . . 0 N--CA 1.449 -0.491 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.626 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.564 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.2 pt-20 . . . . . 0 CA--C 1.515 -0.387 0 CA-C-O 121.167 0.508 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -60.06 112.03 1.73 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.961 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.781 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.8 mt -106.14 99.05 8.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.528 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.637 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -100.23 96.73 7.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.137 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.49 -83.16 0.01 OUTLIER Glycine 0 C--N 1.321 -0.285 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.966 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.451 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.4 t-160 -64.43 -54.14 37.25 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.241 0.52 . . . . 0.0 111.475 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.445 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.5 m-70 -53.59 -39.06 64.55 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.781 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.5 t80 -65.47 -27.94 68.86 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 112.916 -1.947 . . . . 0.0 109.77 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.643 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.6 t -74.22 -68.01 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.388 -0.824 . . . . 0.0 108.847 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.568 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.4 OUTLIER -43.79 -57.83 3.04 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 123.25 0.344 . . . . 0.0 111.086 179.379 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.831 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.78 -51.82 59.13 Favored 'General case' 0 C--O 1.212 -0.893 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.301 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.637 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.33 -39.64 3.21 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.279 0.561 . . . . 0.0 110.476 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.643 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -76.22 -64.57 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.073 179.29 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -34.45 -41.84 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.523 1.154 . . . . 0.0 110.051 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.868 HG22 ' HG2' ' A' ' 122' ' ' GLN . 68.3 t -73.78 -65.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 112.768 -2.014 . . . . 0.0 113.38 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 11.2 t . . . . . 0 CA--C 1.514 -0.436 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.603 -176.419 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.223 0 CA-C-O 121.076 0.465 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 25.5 ttt180 -77.86 -51.6 10.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.183 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.49 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -51.91 -35.94 47.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.719 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 74.3 m -79.0 -30.67 44.4 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 112.04 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.646 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.5 t -56.89 -45.46 82.57 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.574 -0.451 . . . . 0.0 110.006 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 19.5 mt -81.03 -38.94 26.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.316 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.5 t -106.66 -72.7 0.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.719 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.36 156.79 8.97 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.825 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -113.24 159.68 19.08 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.709 0.766 . . . . 0.0 112.233 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.703 ' O ' HD12 ' A' ' 125' ' ' LEU . 64.0 p -95.78 155.29 16.81 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.293 178.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.903 ' HG2' HG22 ' B' ' 45' ' ' VAL . 20.5 mt-30 -60.25 -3.28 0.59 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.726 ' O ' HG23 ' A' ' 127' ' ' THR . 47.6 mt-30 -87.86 -56.37 3.37 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.595 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.8 t70 -53.1 -54.33 37.15 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.2 mt -56.94 -35.01 68.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.321 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.471 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.0 mt -64.07 -25.54 68.15 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-O 120.822 0.344 . . . . 0.0 110.162 178.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.726 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.2 p -97.14 -6.76 34.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.483 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.75 HD12 ' HA ' ' A' ' 125' ' ' LEU . 29.0 mt . . . . . 0 N--CA 1.452 -0.348 0 CA-C-O 120.886 0.374 . . . . 0.0 110.536 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.464 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.8 pt-20 . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 121.628 0.728 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.99 112.4 2.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.183 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.829 HD13 ' HA ' ' B' ' 38' ' ' PHE . 31.4 mt -112.74 107.29 15.88 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.695 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.646 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -101.84 81.12 2.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.53 0.681 . . . . 0.0 111.206 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 65.09 -81.97 0.07 OUTLIER Glycine 0 C--N 1.321 -0.294 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.932 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -58.0 -56.08 26.61 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 117.315 0.558 . . . . 0.0 110.871 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -52.59 -46.53 66.97 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.829 ' HA ' HD13 ' B' ' 33' ' ' LEU . 24.7 t80 -54.26 -31.01 52.53 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.187 -1.824 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.703 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.2 t -72.83 -52.49 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.533 ' NE ' HG12 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -51.53 -65.04 0.63 Allowed 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.61 0.569 . . . . 0.0 110.912 179.421 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.879 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.32 -45.88 55.09 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -47.05 -40.89 15.82 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.255 0.55 . . . . 0.0 109.813 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.703 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.6 OUTLIER -73.48 -65.13 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.029 178.342 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -34.0 -41.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.086 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.903 HG22 ' HG2' ' A' ' 122' ' ' GLN . 78.5 t -74.5 -60.37 2.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 113.417 -1.72 . . . . 0.0 112.447 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.2 t . . . . . 0 CA--C 1.514 -0.437 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.68 -176.313 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.46 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.518 -0.255 0 CA-C-O 121.367 0.604 . . . . 0.0 109.713 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -77.18 -24.95 51.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.194 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.483 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -63.83 -54.91 27.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.473 179.382 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.578 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.7 m -74.82 -14.13 60.65 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.586 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.612 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.0 t -76.91 -28.16 55.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.032 0.444 . . . . 0.0 110.075 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.0 mt -81.11 -34.44 32.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.699 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 m -138.33 -36.09 0.59 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.417 ' CA ' ' HA ' ' B' ' 32' ' ' LYS . . . 118.36 171.74 15.34 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.763 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.659 ' HB2' HD12 ' B' ' 33' ' ' LEU . 71.2 m -140.58 138.38 34.41 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.287 0.565 . . . . 0.0 112.463 -179.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.711 ' O ' HD12 ' A' ' 125' ' ' LEU . 74.2 p -77.25 157.88 30.58 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.501 179.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.886 ' HG2' HG22 ' B' ' 45' ' ' VAL . 15.8 mt-30 -53.57 -20.63 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.614 ' O ' HG23 ' A' ' 127' ' ' THR . 21.7 mt-30 -70.53 -54.02 13.82 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.591 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -53.94 -53.03 58.45 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 178.258 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.722 HD21 HD13 ' B' ' 33' ' ' LEU . 1.1 mt -61.12 -30.72 70.54 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.629 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 7.0 mt -63.44 -27.17 69.1 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.614 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.5 OUTLIER -92.38 -16.0 26.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.902 179.759 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 14.5 mt . . . . . 0 N--CA 1.446 -0.638 0 CA-C-O 121.561 0.696 . . . . 0.0 109.267 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.409 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.8 pt-20 . . . . . 0 CA--C 1.514 -0.417 0 CA-C-O 121.42 0.628 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.417 ' HA ' ' CA ' ' A' ' 119' ' ' GLY . 13.9 mtpt -63.16 108.2 1.21 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.625 -178.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.788 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 9.7 mt -101.91 98.86 9.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.959 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.612 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.7 t -99.83 94.09 6.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.251 0.548 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.11 -83.4 0.02 OUTLIER Glycine 0 C--N 1.321 -0.264 0 CA-C-N 115.029 -0.987 . . . . 0.0 112.991 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -60.19 -57.3 13.38 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.91 0.355 . . . . 0.0 111.493 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 8.2 m170 -52.96 -44.73 67.35 Favored 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.788 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 20.2 t80 -57.7 -28.99 64.32 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.897 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.585 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.0 OUTLIER -74.15 -60.22 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.145 177.815 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.542 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.5 OUTLIER -49.43 -64.34 0.84 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 119.414 -0.327 . . . . 0.0 110.632 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.882 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -46.05 -49.23 16.55 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.498 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.625 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.56 -41.0 6.16 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.322 0.582 . . . . 0.0 110.431 179.883 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.585 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -79.84 -59.74 2.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.489 179.595 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . 0.435 ' HE ' ' HB3' ' B' ' 40' ' ' ARG . 4.8 mtt180 -36.22 -39.37 0.18 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.104 0.954 . . . . 0.0 109.335 177.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.886 HG22 ' HG2' ' A' ' 122' ' ' GLN . 59.8 t -76.02 -53.17 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 113.538 -1.664 . . . . 0.0 111.387 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 45.6 t . . . . . 0 N--CA 1.45 -0.433 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.271 -177.004 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.449 0 CA-C-O 121.682 0.753 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.07 -34.34 59.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.335 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.43 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -62.19 -29.26 70.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.334 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.715 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 60.3 m -84.01 -33.91 24.42 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.813 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.596 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.6 t -54.9 -35.5 64.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 44.2 mt -82.4 -53.72 5.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.47 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 58.3 m -106.91 -58.46 1.93 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.715 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 128.64 174.22 13.67 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.372 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.999 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -133.13 155.17 49.77 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.376 0.588 . . . . 0.0 111.701 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.69 ' O ' HD12 ' A' ' 125' ' ' LEU . 67.8 p -97.71 159.94 14.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.524 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.815 ' HG2' HG22 ' B' ' 45' ' ' VAL . 16.3 mt-30 -62.13 2.67 0.22 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.632 ' O ' HG23 ' A' ' 127' ' ' THR . 19.9 mt-30 -94.92 -57.01 2.56 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.495 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 2.7 m-20 -55.41 -51.0 68.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mt -59.04 -34.73 72.25 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.097 179.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.481 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.4 mt -63.24 -30.35 71.51 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.745 0.307 . . . . 0.0 110.796 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.632 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -94.43 -5.46 46.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.519 -179.613 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.5 HD13 ' HZ ' ' B' ' 38' ' ' PHE . 95.5 mt . . . . . 0 N--CA 1.452 -0.342 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.799 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.494 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.9 pt-20 . . . . . 0 CA--C 1.515 -0.393 0 CA-C-O 121.526 0.679 . . . . 0.0 111.892 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 118' ' ' SER . 81.6 mttt -65.64 109.59 2.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.204 -1.362 . . . . 0.0 112.799 -177.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.999 HD12 ' SG ' ' A' ' 120' ' ' CYS . 58.7 mt -105.78 96.61 6.61 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.537 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.596 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.8 t -92.23 84.44 5.22 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.351 -179.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 63.11 -77.79 0.03 OUTLIER Glycine 0 C--N 1.32 -0.35 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.976 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.485 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 3.9 t-160 -65.1 -52.46 55.3 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.32 0.56 . . . . 0.0 111.054 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.529 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 11.6 m170 -55.23 -35.32 64.81 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.774 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 47.0 t80 -69.5 -26.42 64.53 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 113.007 -1.906 . . . . 0.0 109.664 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.648 ' O ' HG23 ' B' ' 43' ' ' VAL . 2.3 t -73.71 -68.33 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 176.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.526 ' N ' HG12 ' B' ' 39' ' ' VAL . 2.4 mpt_? -43.76 -55.11 4.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.525 0.516 . . . . 0.0 110.942 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.925 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -56.12 -49.35 74.15 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.084 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -45.45 -40.88 8.8 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.469 0.652 . . . . 0.0 110.104 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.648 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -71.18 -62.02 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.907 178.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 4.9 mtt180 -38.68 -38.33 0.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.337 1.065 . . . . 0.0 109.759 177.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.925 HG23 ' O ' ' B' ' 41' ' ' ALA . 58.5 t -76.18 -63.38 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 113.072 -1.877 . . . . 0.0 114.024 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 CA--C 1.514 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.54 -176.01 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.464 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.517 -0.305 0 CA-C-O 121.403 0.62 . . . . 0.0 109.617 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.65 -26.0 50.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.474 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.452 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -63.16 -56.24 18.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.571 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.629 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -72.98 -29.17 62.85 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.791 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.637 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.5 t -57.44 -37.58 73.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.729 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 14.3 mt -79.58 -56.44 4.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.833 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.9 m -105.27 -43.16 5.07 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.418 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 115.01 160.67 12.92 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.386 -178.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.43 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.9 m -131.21 148.17 52.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.307 0.575 . . . . 0.0 112.534 -179.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.829 ' O ' HD12 ' A' ' 125' ' ' LEU . 12.3 p -85.44 164.47 17.86 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.038 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.895 ' HG2' HG22 ' B' ' 45' ' ' VAL . 40.8 mt-30 -63.11 -3.68 1.9 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.213 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.632 ' O ' HG23 ' A' ' 127' ' ' THR . 11.8 mm-40 -87.87 -54.28 4.32 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.6 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.49 -54.07 48.47 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.389 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.829 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -57.46 -32.8 67.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.533 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.479 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.8 mt -64.13 -27.99 69.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.852 0.358 . . . . 0.0 110.11 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.632 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -94.9 -7.35 40.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.232 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.623 HD12 ' HA ' ' A' ' 125' ' ' LEU . 34.5 mt . . . . . 0 N--CA 1.449 -0.48 0 CA-C-O 120.759 0.314 . . . . 0.0 110.521 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.56 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.1 pt-20 . . . . . 0 CA--C 1.516 -0.344 0 CA-C-O 121.211 0.529 . . . . 0.0 110.201 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -62.73 112.58 2.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.923 -177.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.793 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 4.8 mt -106.42 99.68 9.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.421 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.637 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -99.98 98.74 9.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.395 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 56.66 -83.27 0.01 OUTLIER Glycine 0 C--N 1.322 -0.242 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.057 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.446 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.3 t-160 -63.4 -55.14 26.78 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 117.281 0.541 . . . . 0.0 111.439 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -53.06 -42.84 66.21 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.793 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 19.7 t80 -60.09 -30.58 69.34 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.001 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.651 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.4 t -72.76 -64.2 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.604 ' HE ' HG12 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -42.71 -62.63 0.95 Allowed 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 123.617 0.573 . . . . 0.0 110.634 179.065 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.846 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.0 -52.72 40.0 Favored 'General case' 0 C--O 1.21 -0.975 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.233 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.79 -38.81 3.43 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.042 0.448 . . . . 0.0 110.439 -179.88 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.651 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -76.98 -64.4 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.055 179.058 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 -33.83 -43.56 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.468 1.128 . . . . 0.0 110.136 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.895 HG22 ' HG2' ' A' ' 122' ' ' GLN . 57.3 t -72.47 -58.86 4.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 112.799 -2.001 . . . . 0.0 112.676 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.5 t . . . . . 0 C--N 1.325 -0.46 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.508 -176.181 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.469 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 121.237 0.541 . . . . 0.0 110.417 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -21.35 52.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.566 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.447 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -71.02 -51.29 26.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.983 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.587 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.4 m -74.56 -19.09 60.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.113 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.64 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.3 t -71.12 -48.58 51.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.786 0.326 . . . . 0.0 111.164 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.1 mt -80.85 -15.08 57.3 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 47.8 t -134.44 -52.73 0.82 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.494 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 115.69 147.78 9.12 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.448 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.628 ' HB2' HD12 ' B' ' 33' ' ' LEU . 95.4 m -122.67 140.7 52.56 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.733 ' O ' HD12 ' A' ' 125' ' ' LEU . 75.3 p -76.72 155.51 33.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.756 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.891 ' HG2' HG22 ' B' ' 45' ' ' VAL . 20.2 mt-30 -55.15 -20.25 9.75 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.57 ' O ' HG23 ' A' ' 127' ' ' THR . 6.9 mp0 -69.84 -51.83 30.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.622 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -54.63 -57.11 12.72 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.019 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.741 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -56.21 -30.75 62.75 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.64 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.2 mt -62.88 -31.71 72.81 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.069 0.461 . . . . 0.0 109.847 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.57 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -100.54 -1.44 35.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.707 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 72.7 mt . . . . . 0 N--CA 1.45 -0.442 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.129 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.557 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.3 tp10 . . . . . 0 CA--C 1.51 -0.577 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 60.4 mttt -68.14 101.99 1.26 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.431 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.77 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.5 mt -99.91 98.44 9.22 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.42 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.9 t -98.71 94.57 6.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.167 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.49 -80.6 0.01 OUTLIER Glycine 0 C--N 1.32 -0.357 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.901 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 3.5 t-160 -65.98 -55.24 17.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.184 0.492 . . . . 0.0 111.494 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.459 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -53.14 -36.85 61.28 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 177.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.77 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.9 t80 -67.72 -29.22 68.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 112.988 -1.914 . . . . 0.0 109.822 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.558 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.5 t -73.11 -65.61 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.387 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.52 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.9 OUTLIER -48.34 -58.6 4.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 119.204 -0.426 . . . . 0.0 110.934 179.221 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.8 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.53 -47.07 57.69 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.519 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.628 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.17 -39.24 13.35 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.205 0.526 . . . . 0.0 110.275 179.582 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.558 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -79.76 -62.48 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.382 179.697 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mtt180 -32.25 -40.8 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.437 1.113 . . . . 0.0 108.866 176.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.891 HG22 ' HG2' ' A' ' 122' ' ' GLN . 91.2 t -74.93 -66.43 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 112.949 -1.932 . . . . 0.0 112.215 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 47.7 t . . . . . 0 CA--C 1.513 -0.455 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.057 -175.848 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.156 0 CA-C-O 121.292 0.568 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -77.49 -52.3 9.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.334 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.428 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -54.8 -31.59 59.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.732 -178.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.725 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 68.1 m -79.92 -22.18 43.03 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.956 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.627 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.8 t -70.6 -33.94 71.6 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.4 mt -84.12 -24.72 30.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.155 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.474 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 78.1 p -136.58 -63.04 0.64 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.753 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.725 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.21 156.11 8.76 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.761 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.968 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -107.96 155.85 19.87 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 121.666 0.746 . . . . 0.0 112.213 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 125' ' ' LEU . 32.7 p -94.84 151.27 19.37 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.441 178.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.919 ' HG2' HG22 ' B' ' 45' ' ' VAL . 9.9 mt-30 -56.56 -8.07 0.5 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.611 ' O ' HG23 ' A' ' 127' ' ' THR . 3.9 mm100 -83.46 -54.96 4.58 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.554 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 1.7 t70 -54.27 -54.71 36.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.674 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -56.67 -34.01 66.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.442 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.9 mt -62.89 -29.57 70.87 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.919 0.39 . . . . 0.0 110.572 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -99.75 -2.08 36.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.386 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.572 HD12 ' HA ' ' A' ' 125' ' ' LEU . 72.0 mt . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 120.727 0.299 . . . . 0.0 110.694 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.63 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 4.7 tp10 . . . . . 0 CA--C 1.512 -0.509 0 CA-C-O 121.234 0.54 . . . . 0.0 111.265 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 118' ' ' SER . 4.0 mtpm? -63.24 100.02 0.21 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.62 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.968 HD12 ' SG ' ' A' ' 120' ' ' CYS . 63.4 mt -100.24 102.25 13.48 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.826 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.627 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.1 t -98.14 76.86 2.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.361 0.6 . . . . 0.0 111.223 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.27 -75.61 0.5 Allowed Glycine 0 C--N 1.319 -0.373 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.857 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.46 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 5.2 t-160 -66.63 -53.17 37.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.496 0.648 . . . . 0.0 110.841 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.5 m170 -53.7 -38.17 63.99 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.802 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 37.8 t80 -64.75 -30.25 71.26 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.037 -1.892 . . . . 0.0 109.835 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.599 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.5 t -71.09 -66.32 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.562 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -46.26 -61.35 1.82 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 119.38 -0.343 . . . . 0.0 110.408 178.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.863 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -48.35 -50.14 31.61 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.513 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.679 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -45.16 -41.56 8.21 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.3 0.571 . . . . 0.0 110.067 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.599 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -74.81 -64.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.191 179.165 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 5.5 mtt180 -33.28 -41.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 122.289 1.042 . . . . 0.0 109.86 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.919 HG22 ' HG2' ' A' ' 122' ' ' GLN . 59.3 t -74.05 -58.54 4.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 113.277 -1.783 . . . . 0.0 112.561 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . 0.426 ' HB2' ' HA ' ' A' ' 126' ' ' LEU . 22.2 t . . . . . 0 CA--C 1.515 -0.382 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.277 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.315 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.84 -18.8 53.43 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.951 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.438 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -72.55 -56.25 5.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.857 -179.585 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.612 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -74.35 -21.73 59.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.904 0.383 . . . . 0.0 110.923 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.653 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.7 t -68.99 -47.85 64.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.9 0.381 . . . . 0.0 110.903 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.2 mt -81.8 -17.5 47.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.287 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 t -132.21 -54.79 0.97 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.565 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 116.95 149.21 9.02 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.509 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.465 ' HB2' HD12 ' B' ' 33' ' ' LEU . 78.0 m -127.22 146.28 50.47 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.808 ' O ' HD12 ' A' ' 125' ' ' LEU . 65.9 p -87.23 165.06 15.97 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.833 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.842 ' HG2' HG22 ' B' ' 45' ' ' VAL . 14.3 mt-30 -61.68 -0.59 0.46 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 177.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.665 ' O ' HG23 ' A' ' 127' ' ' THR . 79.7 mt-30 -89.85 -54.37 4.08 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 176.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.53 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -57.99 -50.12 74.5 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.808 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mp -60.48 -31.72 70.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.24 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.452 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.2 mt -64.55 -28.43 69.64 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 120.961 0.41 . . . . 0.0 110.007 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -95.58 -5.57 42.3 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.501 -179.795 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 44.5 mt . . . . . 0 N--CA 1.449 -0.477 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.175 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.631 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.2 tp10 . . . . . 0 CA--C 1.51 -0.589 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 57.6 mttt -65.92 102.42 0.78 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.565 0.698 . . . . 0.0 112.133 -178.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.769 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.0 mt -103.94 100.38 10.16 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.581 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.653 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -99.9 92.28 5.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.88 -80.25 0.02 OUTLIER Glycine 0 C--N 1.322 -0.235 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.889 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.498 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 4.1 t-160 -65.19 -55.66 17.32 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 117.337 0.568 . . . . 0.0 111.182 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.455 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.7 m-70 -52.95 -37.53 61.15 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.769 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 25.4 t80 -67.14 -27.94 67.72 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.02 -1.9 . . . . 0.0 109.786 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.589 HG12 ' N ' ' B' ' 40' ' ' ARG . 1.0 OUTLIER -74.46 -65.77 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.226 177.496 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.589 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -46.01 -57.97 3.97 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 119.385 -0.341 . . . . 0.0 110.848 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.882 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.0 -51.74 55.26 Favored 'General case' 0 C--O 1.212 -0.914 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.975 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.641 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -42.45 -38.06 1.79 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.281 0.562 . . . . 0.0 110.473 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.589 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.3 OUTLIER -77.31 -64.78 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.1 179.073 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 5.0 mtt180 -34.21 -40.8 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 122.464 1.126 . . . . 0.0 109.767 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.882 HG23 ' O ' ' B' ' 41' ' ' ALA . 60.8 t -74.51 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.778 -179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.0 t . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.538 -176.307 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 121.448 0.642 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.6 mmm180 -78.51 -23.86 46.1 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.911 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.462 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -70.08 -51.21 33.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.773 179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.571 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 4.5 m -75.49 -16.03 60.35 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.679 -0.409 . . . . 0.0 110.957 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.643 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.9 t -71.57 -53.02 15.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.857 0.361 . . . . 0.0 111.272 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.8 mt -79.84 -13.94 59.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.338 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.7 t -129.29 -55.63 1.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.462 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 114.4 144.11 8.5 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.565 ' HB2' HD12 ' B' ' 33' ' ' LEU . 89.8 m -122.03 142.59 50.17 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.748 ' O ' HD12 ' A' ' 125' ' ' LEU . 73.3 p -75.81 157.05 33.88 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.648 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.731 ' HG2' HG22 ' B' ' 45' ' ' VAL . 18.2 mt-30 -58.83 -14.46 8.92 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.627 ' O ' HG23 ' A' ' 127' ' ' THR . 26.6 mt-30 -74.31 -51.96 13.65 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.628 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.4 OUTLIER -52.66 -57.39 10.22 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.977 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.756 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -54.36 -34.43 61.14 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.488 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.459 HD23 ' HB2' ' B' ' 46' ' ' CYS . 6.3 mt -60.76 -32.94 72.22 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.184 0.516 . . . . 0.0 110.001 178.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.627 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -90.94 -9.46 46.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.631 -179.565 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 27.5 mt . . . . . 0 N--CA 1.45 -0.456 0 CA-C-O 120.965 0.412 . . . . 0.0 110.069 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 5.5 tp10 . . . . . 0 CA--C 1.511 -0.528 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -67.42 101.84 1.03 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.387 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.718 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.2 mt -97.26 96.68 8.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.324 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.643 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -97.66 88.7 4.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.049 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.553 ' O ' HG23 ' B' ' 39' ' ' VAL . . . 64.22 -78.23 0.05 OUTLIER Glycine 0 C--N 1.318 -0.426 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.639 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.541 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 5.6 t-160 -66.37 -54.42 24.7 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 117.336 0.568 . . . . 0.0 111.659 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.493 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 6.8 m-70 -54.51 -34.26 61.35 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.718 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 27.3 t80 -71.68 -27.04 62.78 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.167 -1.833 . . . . 0.0 109.654 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.561 ' O ' HG23 ' B' ' 43' ' ' VAL . 2.3 t -73.61 -62.53 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.615 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.441 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.2 OUTLIER -60.72 -42.48 97.35 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.022 179.272 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.748 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -61.03 -40.85 95.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.438 1.017 . . . . 0.0 109.225 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.612 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.6 -47.02 67.21 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.125 0.488 . . . . 0.0 111.28 179.834 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.1 OUTLIER -76.09 -49.24 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.174 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . 0.439 ' HD3' ' C ' ' B' ' 44' ' ' ARG . 0.0 OUTLIER -43.91 -40.58 4.67 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-O 122.864 1.316 . . . . 0.0 107.764 177.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.756 HG21 ' HB2' ' A' ' 125' ' ' LEU . 56.0 t -74.05 -62.66 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.195 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . 0.459 ' HB2' HD23 ' A' ' 126' ' ' LEU . 49.1 t . . . . . 0 N--CA 1.451 -0.422 0 CA-C-N 113.917 -1.492 . . . . 0.0 111.927 -176.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.456 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.52 -0.184 0 CA-C-O 121.254 0.549 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.448 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.7 OUTLIER -78.3 -35.15 48.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.879 178.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.489 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -59.97 -56.66 18.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.135 179.842 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.572 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 9.3 m -69.38 -16.41 63.51 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.287 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.628 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -71.34 -46.72 59.9 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.599 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 9.0 mt -80.58 -16.59 53.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 80.5 p -133.68 -51.48 0.85 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.401 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 117.98 160.85 11.75 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.521 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 92.1 m -136.89 143.46 43.0 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.766 ' O ' HD12 ' A' ' 125' ' ' LEU . 82.3 p -80.82 161.29 24.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.554 179.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.922 ' HG2' HG22 ' B' ' 45' ' ' VAL . 27.8 mt-30 -58.28 -15.17 9.17 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.654 ' O ' HG23 ' A' ' 127' ' ' THR . 25.5 mt-30 -73.77 -54.68 7.49 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.602 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -54.45 -55.33 29.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.848 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.766 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mp -58.83 -31.08 68.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.965 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 6.8 mt -64.77 -27.6 69.01 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.866 0.365 . . . . 0.0 110.158 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -97.94 -6.52 32.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.266 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 40.7 mt . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.748 0.309 . . . . 0.0 110.702 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.578 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.0 tp10 . . . . . 0 CA--C 1.513 -0.461 0 CA-C-O 120.994 0.426 . . . . 0.0 110.399 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -64.65 102.54 0.58 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.793 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.772 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 34.2 mt -99.58 104.88 16.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.14 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.628 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.6 OUTLIER -103.26 95.31 6.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.447 0.641 . . . . 0.0 111.124 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 58.97 -87.66 0.02 OUTLIER Glycine 0 C--O 1.227 -0.299 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.17 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.497 ' O ' ' HG3' ' B' ' 40' ' ' ARG . 18.7 t-160 -59.02 -56.63 19.8 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 117.206 0.503 . . . . 0.0 111.597 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -48.74 -48.78 40.38 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.772 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 22.6 t80 -55.94 -31.28 62.8 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 112.994 -1.912 . . . . 0.0 110.424 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.704 ' O ' HG23 ' B' ' 43' ' ' VAL . 0.5 OUTLIER -72.79 -45.04 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.787 178.189 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' B' ' 36' ' ' HIS . 1.9 mtt180 -61.09 -61.03 2.87 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.879 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.825 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.68 -45.56 66.88 Favored 'General case' 0 C--O 1.208 -1.098 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -45.84 -38.65 7.53 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.349 0.595 . . . . 0.0 109.724 179.433 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.4 OUTLIER -76.72 -63.41 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.4 178.79 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtm180 -36.7 -40.62 0.27 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.439 1.114 . . . . 0.0 110.195 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.922 HG22 ' HG2' ' A' ' 122' ' ' GLN . 99.4 t -75.19 -65.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 112.949 -1.932 . . . . 0.0 113.4 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.613 -176.053 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 120.948 0.404 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.5 OUTLIER -76.89 -40.5 47.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.654 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.458 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -59.83 -34.82 73.58 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.811 -179.39 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.783 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 73.5 m -77.5 -21.05 53.35 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.071 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.603 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.3 t -65.41 -43.4 90.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 20.9 mt -84.29 -20.71 31.69 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.215 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.514 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 43.2 t -127.53 -75.86 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 111.364 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.783 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 132.76 155.03 7.73 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.124 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.983 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -114.48 149.75 35.87 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.538 0.685 . . . . 0.0 112.273 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.702 ' O ' HD12 ' A' ' 125' ' ' LEU . 39.0 p -87.89 150.86 23.24 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.051 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.901 ' HG2' HG22 ' B' ' 45' ' ' VAL . 24.3 mt-30 -53.06 -19.22 2.58 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.525 ' O ' HG23 ' A' ' 127' ' ' THR . 0.0 OUTLIER -72.55 -53.61 11.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.503 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 6.0 t70 -55.1 -52.18 64.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.83 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.1 mt -59.01 -31.9 69.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.856 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.532 ' HG ' HG13 ' B' ' 45' ' ' VAL . 7.7 mt -63.3 -28.94 70.36 Favored 'General case' 0 C--O 1.231 0.095 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.052 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -98.09 -3.89 36.97 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.376 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.83 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.1 mt . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 120.759 0.314 . . . . 0.0 110.444 -179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.514 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.3 pt-20 . . . . . 0 CA--C 1.511 -0.555 0 CA-C-O 121.62 0.724 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 118' ' ' SER . 79.8 mttt -60.19 104.94 0.36 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.288 -1.324 . . . . 0.0 112.604 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.983 HD12 ' SG ' ' A' ' 120' ' ' CYS . 63.9 mt -101.33 98.79 9.12 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.186 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.603 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.3 t -94.9 78.32 3.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.388 0.613 . . . . 0.0 111.19 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 67.43 -75.15 0.2 Allowed Glycine 0 C--N 1.32 -0.319 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.744 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.508 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.5 t-160 -65.81 -52.23 52.35 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 117.237 0.519 . . . . 0.0 110.912 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.528 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.8 m170 -55.44 -36.99 67.11 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 176.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.791 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 39.4 t80 -67.21 -27.3 67.14 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 112.987 -1.915 . . . . 0.0 109.683 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.546 HG12 ' N ' ' B' ' 40' ' ' ARG . 1.6 t -73.13 -66.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-N 115.118 -0.947 . . . . 0.0 108.811 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.546 ' N ' HG12 ' B' ' 39' ' ' VAL . 2.5 mpt_? -48.65 -59.64 3.37 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 119.267 -0.396 . . . . 0.0 110.461 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.845 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -48.45 -43.81 34.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.805 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.663 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.94 -42.85 65.84 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 121.033 0.444 . . . . 0.0 110.332 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.52 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -74.45 -59.5 3.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.128 179.214 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mmm180 -33.56 -40.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.437 1.113 . . . . 0.0 108.504 176.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.901 HG22 ' HG2' ' A' ' 122' ' ' GLN . 75.0 t -75.84 -65.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 112.997 -1.91 . . . . 0.0 111.751 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 31.8 t . . . . . 0 N--CA 1.449 -0.49 0 CA-C-N 114.225 -1.352 . . . . 0.0 111.671 -176.398 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.425 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.516 -0.353 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.06 -16.46 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.979 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.409 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -73.25 -46.1 52.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.599 179.643 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.588 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.2 m -83.06 -20.64 34.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.391 . . . . 0.0 110.825 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.661 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.4 t -69.72 -50.31 44.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.6 mt -80.95 -14.88 57.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.024 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 27.2 t -131.91 -59.23 0.95 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.584 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.3 147.48 7.89 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 -178.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.578 ' HB2' HD12 ' B' ' 33' ' ' LEU . 94.4 m -123.06 145.0 48.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.803 ' O ' HD12 ' A' ' 125' ' ' LEU . 39.9 p -82.21 157.91 23.77 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.742 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.922 ' HG2' HG22 ' B' ' 45' ' ' VAL . 7.0 mt-30 -56.85 -18.61 13.67 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.69 ' O ' HG23 ' A' ' 127' ' ' THR . 47.2 mt-30 -72.15 -52.07 18.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.577 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.3 OUTLIER -54.62 -57.01 13.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.471 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.803 HD12 ' O ' ' A' ' 121' ' ' THR . 1.3 mp -59.26 -28.87 67.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.144 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.431 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 7.1 mt -66.79 -27.01 67.23 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.857 0.36 . . . . 0.0 110.084 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -100.95 -3.73 28.96 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.354 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.678 HD12 ' HA ' ' A' ' 125' ' ' LEU . 28.2 mt . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.854 0.359 . . . . 0.0 110.369 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.2 tp10 . . . . . 0 CA--C 1.509 -0.621 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 12.7 mtpt -69.86 102.74 2.02 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.688 0.756 . . . . 0.0 111.612 -178.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.765 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.2 mt -100.91 101.59 12.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.386 -1.279 . . . . 0.0 111.743 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.661 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -98.6 91.25 5.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.305 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.72 -79.5 0.01 OUTLIER Glycine 0 C--N 1.321 -0.258 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.914 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.477 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 3.4 t-160 -63.6 -54.94 28.08 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.106 0.453 . . . . 0.0 111.191 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.403 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 4.5 m-70 -54.96 -38.31 67.6 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.765 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 26.5 t80 -65.25 -26.99 68.34 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.062 -1.881 . . . . 0.0 109.626 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.64 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.4 t -74.38 -65.11 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.561 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.1 OUTLIER -43.69 -62.37 1.12 Allowed 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 123.259 0.349 . . . . 0.0 110.721 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.762 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.54 -50.85 52.27 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 119.807 -0.757 . . . . 0.0 109.032 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.669 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -42.39 -38.93 2.02 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.374 0.607 . . . . 0.0 110.267 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.64 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.3 OUTLIER -78.59 -67.58 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.272 178.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 10.0 mtt180 -32.26 -42.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 122.396 1.093 . . . . 0.0 110.35 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.922 HG22 ' HG2' ' A' ' 122' ' ' GLN . 92.5 t -73.04 -59.87 2.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 113.106 -1.861 . . . . 0.0 112.924 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 13.5 t . . . . . 0 CA--C 1.513 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.137 -176.202 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.397 0.618 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -79.83 -54.11 6.14 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.409 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.461 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -50.61 -32.06 17.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.144 -179.489 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.665 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 72.7 m -85.42 -34.66 21.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.568 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.591 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.0 t -51.11 -36.43 40.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.223 0.535 . . . . 0.0 109.602 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 75.6 mt -81.41 -59.0 2.79 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.245 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.8 m -101.59 -57.03 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.836 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.665 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 124.39 163.14 11.61 Favored Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.624 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.768 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -111.86 167.98 9.94 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.453 0.644 . . . . 0.0 111.432 179.802 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.699 ' O ' HD12 ' A' ' 125' ' ' LEU . 42.3 p -103.44 155.28 18.62 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 114.755 -1.111 . . . . 0.0 109.496 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.886 ' HG2' HG22 ' B' ' 45' ' ' VAL . 31.2 mt-30 -58.84 -5.75 0.66 Allowed 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.626 HE21 HD12 ' A' ' 126' ' ' LEU . 1.4 mp0 -88.42 -51.78 5.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.599 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t70 -55.01 -56.2 22.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.752 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.1 mt -56.01 -32.05 63.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.714 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.626 HD12 HE21 ' A' ' 123' ' ' GLN . 5.8 mt -62.7 -30.59 71.51 Favored 'General case' 0 CA--C 1.524 -0.053 0 CA-C-O 121.028 0.442 . . . . 0.0 110.191 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.562 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -96.42 -5.25 40.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.559 -179.725 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.9 mt . . . . . 0 N--CA 1.45 -0.428 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.992 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 10.9 pt-20 . . . . . 0 CA--C 1.514 -0.439 0 CA-C-O 121.592 0.71 . . . . 0.0 110.936 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 82.0 mttt -55.54 117.5 3.64 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.322 -1.308 . . . . 0.0 112.478 -178.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.809 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 21.4 mt -116.93 100.91 8.08 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.183 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.591 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 83.2 m -95.79 76.78 3.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.27 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.34 -81.98 0.2 Allowed Glycine 0 C--O 1.229 -0.193 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.842 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.563 ' O ' ' HG3' ' B' ' 40' ' ' ARG . 11.3 t-160 -60.27 -53.41 57.99 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 117.285 0.542 . . . . 0.0 110.725 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.597 ' HA ' ' HE ' ' B' ' 40' ' ' ARG . 13.1 m-70 -52.58 -45.13 66.33 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.809 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 24.2 t80 -56.03 -29.36 60.3 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 113.104 -1.862 . . . . 0.0 109.85 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.704 ' O ' HG23 ' B' ' 43' ' ' VAL . 0.9 OUTLIER -73.09 -57.63 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.387 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.597 ' HE ' ' HA ' ' B' ' 37' ' ' HIS . 23.9 mtm180 -44.92 -66.7 0.36 Allowed 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.159 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.892 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.08 -46.5 61.8 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.669 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.82 -39.11 17.43 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.265 0.555 . . . . 0.0 109.792 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.704 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.7 OUTLIER -73.22 -65.03 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.95 178.238 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -34.94 -41.04 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.165 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.892 HG23 ' O ' ' B' ' 41' ' ' ALA . 66.5 t -74.46 -61.86 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 113.34 -1.755 . . . . 0.0 112.89 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.515 -0.391 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.368 -176.285 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.098 0.475 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -77.1 -48.41 17.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.926 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.442 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -55.22 -30.58 60.27 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.095 -179.248 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.673 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 70.7 m -84.01 -29.0 27.3 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.19 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.601 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 51.4 t -54.94 -42.73 72.67 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.407 ' O ' ' HE2' ' B' ' 32' ' ' LYS . 12.0 mt -81.51 -46.48 14.43 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.926 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.0 m -102.92 -74.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.1 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.673 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 135.1 156.93 7.84 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.589 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.946 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -108.46 168.07 9.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.522 0.677 . . . . 0.0 111.765 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.754 ' O ' HD12 ' A' ' 125' ' ' LEU . 26.9 p -107.69 158.67 17.08 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.696 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.848 ' HG2' HG22 ' B' ' 45' ' ' VAL . 30.4 mt-30 -62.57 -2.38 1.07 Allowed 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.717 ' O ' HG23 ' A' ' 127' ' ' THR . 27.1 mt-30 -90.65 -57.07 2.95 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 176.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.537 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.5 OUTLIER -54.44 -53.39 54.82 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.304 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.754 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mt -56.05 -36.37 67.96 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.789 178.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' B' ' 46' ' ' CYS . 5.6 mt -62.27 -31.06 71.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 120.974 0.416 . . . . 0.0 109.942 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.717 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -90.19 -7.72 52.91 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.47 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.604 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.4 mt . . . . . 0 N--CA 1.449 -0.477 0 CA-C-O 121.148 0.499 . . . . 0.0 109.984 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.0 pt-20 . . . . . 0 CA--C 1.509 -0.613 0 CA-C-O 121.515 0.674 . . . . 0.0 110.846 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 4.6 mtpm? -60.4 106.58 0.55 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.394 -1.276 . . . . 0.0 112.421 -177.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.946 HD12 ' SG ' ' A' ' 120' ' ' CYS . 60.1 mt -106.14 98.19 7.91 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.945 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.601 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.6 m -93.22 71.05 4.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.214 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.7 -75.18 0.57 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.443 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.549 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 7.8 t-160 -64.27 -51.35 63.98 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 117.133 0.466 . . . . 0.0 110.569 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.574 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 13.2 m-70 -56.13 -39.18 71.85 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.783 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 38.4 t80 -63.46 -26.4 68.71 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.216 179.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.606 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.6 t -74.57 -67.28 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.79 176.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.582 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.7 OUTLIER -45.37 -58.47 3.3 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.207 0.317 . . . . 0.0 110.51 178.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.929 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.1 -51.86 39.5 Favored 'General case' 0 C--O 1.214 -0.81 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.58 -44.67 8.98 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.313 0.578 . . . . 0.0 110.465 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.606 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -69.34 -62.65 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.898 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -35.56 -39.83 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.849 -1.068 . . . . 0.0 109.684 177.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.929 HG23 ' O ' ' B' ' 41' ' ' ALA . 57.3 t -74.13 -58.19 5.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.904 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . 0.608 ' HB2' HD23 ' A' ' 126' ' ' LEU . 39.5 t . . . . . 0 CA--C 1.512 -0.498 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.853 -177.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 120.944 0.402 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.9 mmt180 -77.38 -45.29 26.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.954 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.13 -28.49 64.72 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.956 -179.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.737 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 98.7 m -84.68 -24.09 29.12 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.9 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.646 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.6 t -60.57 -45.18 94.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.96 -40.84 23.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.498 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.8 t -101.68 -78.45 0.53 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.391 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.737 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.2 147.35 6.32 Favored Glycine 0 C--O 1.228 -0.261 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.732 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 1.023 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -109.85 142.4 41.2 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.081 0.467 . . . . 0.0 110.86 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.7 p -72.01 -91.12 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 122.333 1.063 . . . . 0.0 111.453 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.894 ' HG2' HG22 ' B' ' 45' ' ' VAL . 9.7 mt-30 -156.28 -30.64 0.09 Allowed 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.986 -1.915 . . . . 0.0 108.546 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.691 ' O ' HG23 ' A' ' 127' ' ' THR . 49.3 mt-30 -63.66 -49.08 74.61 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.55 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 31.5 t70 -57.05 -56.46 21.44 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.643 HD21 HD13 ' B' ' 33' ' ' LEU . 1.1 mt -58.3 -25.33 61.73 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.76 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.44 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 11.2 mt -71.77 -30.87 66.04 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.874 0.369 . . . . 0.0 110.338 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -92.1 -7.28 49.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.232 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 24.1 mt . . . . . 0 N--CA 1.449 -0.498 0 CA-C-O 120.763 0.316 . . . . 0.0 110.919 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.61 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 10.1 tp10 . . . . . 0 CA--C 1.51 -0.563 0 CA-C-O 121.303 0.573 . . . . 0.0 111.713 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 76.7 mttt -63.27 102.23 0.38 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.912 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 1.023 HD12 ' SG ' ' A' ' 120' ' ' CYS . 60.4 mt -101.16 102.37 13.28 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.911 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.646 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.3 t -97.84 76.0 2.42 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.412 0.625 . . . . 0.0 111.355 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.435 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.35 -73.91 0.56 Allowed Glycine 0 C--N 1.319 -0.416 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.678 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.486 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.2 t-160 -67.73 -52.86 32.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 117.142 0.471 . . . . 0.0 111.002 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.526 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.7 m170 -54.58 -36.22 64.15 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 176.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.785 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 41.7 t80 -66.67 -29.62 69.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 112.96 -1.927 . . . . 0.0 109.517 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.6 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.9 t -71.88 -68.25 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.305 -0.861 . . . . 0.0 108.694 177.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.573 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -45.53 -56.7 4.81 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 119.523 -0.275 . . . . 0.0 110.316 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.87 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.31 -51.61 52.72 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.078 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.65 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.14 -46.53 5.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.413 0.625 . . . . 0.0 110.303 179.852 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.6 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -68.76 -64.71 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.179 179.101 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -34.08 -41.64 0.11 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.249 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.894 HG22 ' HG2' ' A' ' 122' ' ' GLN . 71.5 t -74.26 -60.22 2.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 113.304 -1.771 . . . . 0.0 112.682 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 t . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.522 -176.188 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.416 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.517 -0.318 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 2.3 mpp_? -77.29 -20.96 54.29 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.405 ' CD1' ' C ' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -65.4 -41.68 93.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.981 179.028 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.6 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 2.2 m -92.72 -22.65 19.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.09 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.603 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.1 t -65.02 -36.26 83.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.913 0.387 . . . . 0.0 110.516 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.68 -46.34 15.73 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.856 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 31.7 m -117.37 -44.64 2.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.501 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 119.84 163.72 12.34 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.557 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.617 ' HB2' HD12 ' B' ' 33' ' ' LEU . 81.9 m -134.08 139.04 45.7 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.354 0.597 . . . . 0.0 112.321 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.763 ' O ' HD12 ' A' ' 125' ' ' LEU . 58.8 p -75.41 154.01 37.37 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.695 179.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.759 ' HG2' HG22 ' B' ' 45' ' ' VAL . 13.4 mt-30 -53.38 -19.9 3.95 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.704 HE21 HD12 ' A' ' 126' ' ' LEU . 8.3 mm-40 -68.98 -52.77 25.48 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.539 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.24 -54.01 48.79 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.392 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.763 HD12 ' O ' ' A' ' 121' ' ' THR . 1.4 mp -59.55 -29.87 68.22 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.451 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.704 HD12 HE21 ' A' ' 123' ' ' GLN . 7.5 mt -64.04 -29.97 71.07 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 178.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -101.36 -0.28 35.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.408 -179.882 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.667 HD12 ' HA ' ' A' ' 125' ' ' LEU . 52.0 mt . . . . . 0 N--CA 1.451 -0.414 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.667 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.459 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.6 pt-20 . . . . . 0 CA--C 1.515 -0.4 0 CA-C-O 121.104 0.478 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -61.31 108.15 0.88 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.179 -0.919 . . . . 0.0 113.168 -177.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.753 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.3 mt -103.87 96.8 6.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.896 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.603 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 5.0 t -96.27 90.56 5.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.36 0.6 . . . . 0.0 111.254 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.428 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.71 -78.71 0.02 OUTLIER Glycine 0 C--N 1.321 -0.255 0 CA-C-N 114.849 -1.069 . . . . 0.0 112.973 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.479 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 3.5 t-160 -66.06 -52.62 47.29 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.449 0.624 . . . . 0.0 111.215 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.475 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 4.4 m-70 -55.82 -35.64 66.57 Favored 'General case' 0 CA--C 1.501 -0.906 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 177.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.753 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 28.2 t80 -68.86 -26.73 65.29 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 112.962 -1.926 . . . . 0.0 109.433 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.585 HG12 ' N ' ' B' ' 40' ' ' ARG . 1.4 t -74.17 -67.12 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.852 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.585 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.6 mpt_? -44.74 -61.6 1.52 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.627 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.791 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -49.43 -45.76 46.86 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 119.861 -0.735 . . . . 0.0 109.548 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.644 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.3 OUTLIER -49.78 -41.16 43.65 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.065 0.46 . . . . 0.0 110.346 179.507 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.566 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -75.79 -61.67 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.292 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . 0.421 ' C ' ' O ' ' B' ' 43' ' ' VAL . 5.2 mtt180 -33.19 -41.48 0.07 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.547 1.165 . . . . 0.0 108.853 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.791 HG23 ' O ' ' B' ' 41' ' ' ALA . 82.5 t -74.99 -68.57 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-N 112.871 -1.968 . . . . 0.0 112.621 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 8.5 t . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.866 -175.99 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.404 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.486 0.66 . . . . 0.0 109.722 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -78.77 -26.24 44.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.182 178.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.485 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -70.54 -55.25 9.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.966 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.581 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 10.0 m -68.89 -24.4 64.32 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.242 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.626 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 38.0 t -61.3 -52.89 62.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.813 0.339 . . . . 0.0 111.15 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.0 mt -79.2 -34.72 42.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.056 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 m -106.4 -59.88 1.73 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.567 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.72 162.14 11.65 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.469 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.2 m -143.02 147.09 34.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.799 0.799 . . . . 0.0 112.882 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.829 ' O ' HD12 ' A' ' 125' ' ' LEU . 29.5 p -87.64 169.78 11.84 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.005 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.904 ' HG2' HG22 ' B' ' 45' ' ' VAL . 28.5 mt-30 -66.63 3.46 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.368 178.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.722 ' O ' HG23 ' A' ' 127' ' ' THR . 25.3 mt-30 -94.31 -54.83 3.4 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.57 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -56.33 -53.4 57.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.574 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.829 HD12 ' O ' ' A' ' 121' ' ' THR . 1.0 OUTLIER -56.75 -33.09 66.23 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.32 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.495 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.7 mt -66.78 -35.52 80.28 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.067 0.46 . . . . 0.0 110.033 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.722 HG23 ' O ' ' A' ' 123' ' ' GLN . 5.3 p -82.97 -5.89 59.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.463 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 125' ' ' LEU . 50.3 mt . . . . . 0 N--CA 1.446 -0.653 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.823 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.649 ' HG3' HD21 ' B' ' 33' ' ' LEU . 10.3 pt-20 . . . . . 0 CA--C 1.518 -0.268 0 CA-C-O 121.321 0.582 . . . . 0.0 110.466 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 78.0 mttt -62.93 113.27 2.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.862 -1.063 . . . . 0.0 113.22 -177.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.778 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 6.7 mt -110.19 99.7 8.72 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.842 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.626 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.9 OUTLIER -99.03 95.32 7.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.298 0.57 . . . . 0.0 111.354 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 59.95 -82.42 0.01 OUTLIER Glycine 0 C--N 1.321 -0.254 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.18 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.491 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.0 t-160 -66.21 -51.64 55.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.273 0.536 . . . . 0.0 111.501 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.427 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -54.0 -39.7 66.3 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 176.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.778 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 22.4 t80 -64.39 -28.91 70.01 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 112.692 -2.049 . . . . 0.0 109.597 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.668 ' O ' HG23 ' B' ' 43' ' ' VAL . 2.2 t -72.58 -69.74 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.546 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.8 OUTLIER -41.06 -57.57 2.0 Allowed 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 123.382 0.426 . . . . 0.0 111.258 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.871 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -55.44 -50.24 70.33 Favored 'General case' 0 C--O 1.21 -0.987 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.408 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.706 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -46.5 -35.91 6.18 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.271 0.558 . . . . 0.0 110.749 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.668 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.5 OUTLIER -77.51 -61.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.849 178.998 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 3.6 mmm180 -37.29 -40.37 0.34 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 122.622 1.201 . . . . 0.0 109.493 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.904 HG22 ' HG2' ' A' ' 122' ' ' GLN . 47.4 t -79.31 -71.22 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 112.607 -2.088 . . . . 0.0 114.108 -178.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.518 -0.252 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.789 -176.006 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 121.211 0.529 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.4 mmt180 -77.59 -36.62 51.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.833 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.463 ' CZ ' ' SG ' ' A' ' 120' ' ' CYS . 0.0 OUTLIER -65.54 -36.92 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.365 -179.494 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.568 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 13.5 m -83.15 -22.85 33.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.21 178.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.597 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 40.6 t -61.35 -54.04 48.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.315 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.5 mt -79.3 -32.51 43.53 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 70.7 m -105.5 -61.61 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.476 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 121.13 154.12 9.19 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 -178.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.608 ' HB3' ' HB3' ' A' ' 124' ' ' ASP . 92.1 m -133.78 139.58 46.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.779 ' O ' HD12 ' A' ' 125' ' ' LEU . 43.2 p -73.99 160.36 31.43 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.868 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.874 ' HG2' HG22 ' B' ' 45' ' ' VAL . 18.5 mt-30 -57.61 -16.98 12.01 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.644 ' O ' HG23 ' A' ' 127' ' ' THR . 6.3 mt-30 -70.55 -52.11 23.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.608 ' HB3' ' HB3' ' A' ' 120' ' ' CYS . 7.9 t70 -54.0 -54.36 40.11 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.808 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -58.82 -31.14 68.2 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.776 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.6 mt -64.79 -27.6 69.0 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 109.895 178.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.644 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -91.45 -16.46 27.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.291 -179.821 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 17.1 mt . . . . . 0 N--CA 1.449 -0.515 0 CA-C-O 121.339 0.59 . . . . 0.0 109.865 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.531 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 6.4 tp10 . . . . . 0 CA--C 1.51 -0.59 0 CA-C-O 121.266 0.555 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.8 103.63 1.16 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.301 -179.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.783 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 26.9 mt -98.67 97.1 8.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.713 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.597 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.2 m -95.48 78.13 3.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.297 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.05 -80.49 0.19 Allowed Glycine 0 C--O 1.228 -0.23 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.541 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.485 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 9.2 t-160 -60.3 -55.89 28.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 117.083 0.441 . . . . 0.0 110.696 179.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.54 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 14.5 m-70 -51.83 -43.81 63.3 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.783 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.9 t80 -60.08 -27.99 67.44 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.993 -1.912 . . . . 0.0 110.067 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.592 ' O ' HG23 ' B' ' 43' ' ' VAL . 0.9 OUTLIER -73.11 -62.46 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.307 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.566 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.6 OUTLIER -48.27 -64.14 0.88 Allowed 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.704 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.836 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -47.16 -44.06 21.56 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.105 -0.638 . . . . 0.0 109.782 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.638 ' N ' HD22 ' A' ' 125' ' ' LEU . 0.5 OUTLIER -50.49 -45.22 56.27 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-O 121.451 0.643 . . . . 0.0 110.137 179.622 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.592 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -72.85 -60.62 2.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.129 179.055 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.6 mtt180 -34.66 -41.6 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 122.264 1.03 . . . . 0.0 109.123 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.874 HG22 ' HG2' ' A' ' 122' ' ' GLN . 70.6 t -72.44 -61.1 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.84 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 34.8 t . . . . . 0 N--CA 1.447 -0.611 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.679 -176.417 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 121.244 0.545 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -79.77 -49.89 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.792 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.475 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -53.84 -31.63 50.08 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.965 -179.11 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.699 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 65.0 m -81.53 -34.35 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.446 -0.501 . . . . 0.0 111.828 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . 0.632 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 48.0 t -56.18 -34.64 66.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 98.6 mt -81.6 -55.66 4.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.281 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 16.0 p -104.7 -53.32 2.71 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.994 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . 0.699 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 118.62 162.87 12.31 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.913 -0.661 . . . . 0.0 111.926 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . 0.84 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -117.4 157.28 26.47 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.545 0.688 . . . . 0.0 111.878 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.636 ' O ' HD12 ' A' ' 125' ' ' LEU . 58.3 p -93.69 159.64 15.12 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.526 178.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.876 ' HG2' HG22 ' B' ' 45' ' ' VAL . 26.3 mt-30 -65.37 6.1 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.73 ' O ' HG23 ' A' ' 127' ' ' THR . 56.8 mt-30 -98.26 -53.65 3.29 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 175.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.544 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 3.4 m-20 -56.73 -53.98 51.54 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.727 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.2 mt -56.2 -32.54 64.47 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.901 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.498 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.3 mt -67.29 -37.59 83.66 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' THR . . . . . 0.73 HG23 ' O ' ' A' ' 123' ' ' GLN . 7.0 p -79.17 -5.9 55.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 125' ' ' LEU . 71.0 mt . . . . . 0 N--CA 1.448 -0.558 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.565 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.9 tp10 . . . . . 0 CA--C 1.514 -0.42 0 CA-C-O 121.299 0.571 . . . . 0.0 110.604 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 70.2 mttt -63.75 110.4 2.04 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.739 -178.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.84 HD12 ' SG ' ' A' ' 120' ' ' CYS . 25.6 mt -107.82 108.36 19.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.403 -1.271 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' CYS . . . . . 0.632 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -102.1 77.84 1.72 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.396 0.617 . . . . 0.0 111.06 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.494 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 71.17 -79.9 0.5 Allowed Glycine 0 C--N 1.318 -0.47 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.994 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.517 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 6.1 t-160 -64.37 -51.95 60.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 117.43 0.615 . . . . 0.0 110.981 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' HIS . . . . . 0.418 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.8 m170 -54.58 -37.06 65.07 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.807 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.1 t80 -64.9 -27.99 69.23 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 113.095 -1.866 . . . . 0.0 109.736 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.667 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.7 t -73.63 -64.71 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.517 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.1 mpt_? -44.26 -59.88 2.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 123.37 0.419 . . . . 0.0 111.456 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.924 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -54.09 -46.18 71.99 Favored 'General case' 0 C--O 1.21 -0.974 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.681 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -47.87 -37.9 15.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.479 0.657 . . . . 0.0 110.076 -179.888 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' VAL . . . . . 0.667 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.6 OUTLIER -75.32 -60.45 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.071 178.902 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' ARG . . . . . 0.485 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.6 mtt180 -39.1 -37.54 0.39 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.333 1.063 . . . . 0.0 109.323 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.924 HG23 ' O ' ' B' ' 41' ' ' ALA . 59.2 t -79.31 -70.78 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 113.223 -1.808 . . . . 0.0 113.894 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.0 t . . . . . 0 CA--C 1.518 -0.259 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.773 -176.271 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.822 0.344 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.43 170.28 9.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.946 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -129.35 -155.49 0.7 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.087 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.2 t -74.98 -157.27 0.06 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.844 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -80.99 106.31 5.33 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 178.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.566 ' HB2' ' CZ ' ' B' ' 38' ' ' PHE . 24.5 Cg_endo -58.17 -37.68 94.46 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.23 1.953 . . . . 0.0 113.034 -178.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.46 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -58.13 -42.65 86.26 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.164 0.507 . . . . 0.0 110.999 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -77.62 -48.77 16.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.855 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.465 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.91 -46.41 71.44 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.138 -179.468 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.538 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -74.55 -24.44 58.94 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.326 -0.549 . . . . 0.0 110.802 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.55 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.9 t -63.14 -40.55 97.9 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.787 0.327 . . . . 0.0 110.999 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.4 mt -80.9 -45.0 17.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.821 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 32.5 t -108.31 -53.89 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.462 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 126.03 167.86 12.54 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.777 -0.725 . . . . 0.0 111.621 -179.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.783 ' HB2' HD12 ' B' ' 33' ' ' LEU . 68.1 m -140.64 138.73 34.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.842 HG23 ' HG3' ' B' ' 30' ' ' ARG . 82.0 p -81.24 160.2 24.34 Favored 'General case' 0 CA--C 1.504 -0.824 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.376 179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.908 ' HG2' HG22 ' B' ' 45' ' ' VAL . 7.2 mt-30 -54.31 -17.64 3.18 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.635 ' O ' HG23 ' A' ' 127' ' ' THR . 44.9 mt-30 -71.27 -55.92 7.08 Favored 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.598 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -53.01 -56.01 19.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 108.866 -0.791 . . . . 0.0 108.866 178.435 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mp -57.95 -32.18 67.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.028 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 126' ' ' LEU . 7.0 mt -63.99 -28.3 69.71 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 120.837 0.351 . . . . 0.0 110.24 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.635 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -102.0 -2.6 29.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.722 -179.618 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 59.0 mt -96.1 -16.74 21.38 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.379 -179.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 30.2 p -71.42 155.52 92.65 Favored Pre-proline 0 CA--C 1.531 0.221 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.376 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.51 25.5 0.69 Allowed 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.259 2.64 . . . . 0.0 112.727 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.951 179.816 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.483 0.907 0 N-CA-C 111.009 -0.42 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.424 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 59.1 p 54.34 119.23 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.017 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 87.0 Cg_endo -93.89 -157.33 0.05 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 122.976 2.45 . . . . 0.0 111.847 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.479 ' HB3' ' H ' ' A' ' 122' ' ' GLN . 3.2 pt-20 -81.08 77.21 8.0 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.733 0.778 . . . . 0.0 109.989 179.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 23.4 ttt -82.19 14.94 2.6 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.482 -1.235 . . . . 0.0 110.714 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.842 ' HG3' HG23 ' A' ' 121' ' ' THR . 0.1 OUTLIER 40.65 37.69 0.52 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.767 179.828 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.435 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.6 pt-20 -66.0 157.14 31.64 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.499 0.666 . . . . 0.0 110.934 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -62.6 107.09 0.88 Allowed 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.676 -177.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.783 HD12 ' HB2' ' A' ' 120' ' ' CYS . 24.6 mt -97.59 95.74 7.82 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.692 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.55 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 33.9 m -92.31 85.96 5.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.576 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.88 -78.41 0.01 OUTLIER Glycine 0 C--O 1.227 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.776 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.498 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 5.9 t-160 -63.5 -54.18 40.41 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 117.074 0.437 . . . . 0.0 111.161 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 12.0 m-70 -52.37 -42.84 64.31 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 176.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.744 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 35.1 t80 -62.84 -28.81 70.28 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 112.579 -2.1 . . . . 0.0 109.912 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.679 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.5 t -71.85 -66.9 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.538 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.9 OUTLIER -46.15 -59.12 3.08 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 119.374 -0.346 . . . . 0.0 110.641 178.844 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.821 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.3 -49.5 61.16 Favored 'General case' 0 C--O 1.213 -0.864 0 C-N-CA 119.685 -0.806 . . . . 0.0 109.249 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.682 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.47 -38.62 4.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.381 0.61 . . . . 0.0 110.035 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.645 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -78.05 -65.7 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.332 179.345 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 6.1 mtt180 -32.87 -42.42 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 122.473 1.13 . . . . 0.0 109.94 177.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.908 HG22 ' HG2' ' A' ' 122' ' ' GLN . 58.8 t -74.67 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 113.031 -1.895 . . . . 0.0 113.105 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.3 t -119.44 -55.36 2.13 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.631 -176.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.55 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 146.26 -90.97 0.15 Allowed Glycine 0 C--N 1.317 -0.499 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.392 -178.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.541 ' CA ' ' HE1' ' B' ' 51' ' ' TRP . . . 134.54 -138.56 10.14 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.134 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.612 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 56.8 Cg_endo -70.75 -67.11 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.663 2.242 . . . . 0.0 113.003 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' B' ' 49' ' ' PRO . 82.5 mtm180 -157.44 -44.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.936 0.398 . . . . 0.0 111.49 -178.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.679 ' CH2' HG13 ' B' ' 39' ' ' VAL . 18.3 m95 63.01 -0.76 0.56 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.519 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . 0.462 ' O ' ' N ' ' B' ' 54' ' ' GLU . 69.0 m -71.78 -74.98 0.14 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.752 0.311 . . . . 0.0 110.617 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 81.6 p 53.73 -77.57 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.212 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . 0.462 ' N ' ' O ' ' B' ' 52' ' ' SER . 34.8 tt0 -81.58 -11.67 59.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.124 0.488 . . . . 0.0 110.959 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.009 -179.981 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.811 0.339 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -155.1 -18.95 0.11 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.247 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -107.26 -165.49 1.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.215 0.531 . . . . 0.0 111.352 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 12.1 t -77.56 -159.67 0.15 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.811 178.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -82.76 105.38 4.87 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.57 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 30.5 Cg_endo -59.71 -4.21 2.53 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.43 2.087 . . . . 0.0 113.254 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.41 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -86.09 -54.37 4.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.248 0.547 . . . . 0.0 109.905 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.46 -24.3 56.95 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.491 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.57 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -62.89 -58.16 8.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.184 179.185 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.633 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -71.85 -29.61 64.57 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.437 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.637 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -57.45 -34.86 69.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.006 0.431 . . . . 0.0 110.479 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.9 mt -79.58 -59.67 2.65 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.891 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.3 m -105.14 -39.45 6.2 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 113.0 157.59 12.87 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.418 -178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.449 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.1 m -127.69 148.12 50.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.26 0.553 . . . . 0.0 112.424 -179.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.833 ' O ' HD12 ' A' ' 125' ' ' LEU . 12.5 p -84.76 165.7 17.59 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.334 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.868 ' HG2' HG22 ' B' ' 45' ' ' VAL . 11.1 mt-30 -65.27 0.09 1.56 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.408 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.609 ' O ' HG23 ' A' ' 127' ' ' THR . 23.4 mt-30 -92.06 -53.49 4.23 Favored 'General case' 0 N--CA 1.439 -0.999 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 176.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.593 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.64 -54.22 46.83 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.374 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.833 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -57.47 -33.19 67.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.487 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.438 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.5 mt -62.85 -28.31 69.94 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-O 120.996 0.427 . . . . 0.0 110.205 178.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.609 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -98.07 -4.29 36.23 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.382 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 50.8 mt -93.97 -18.18 22.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.626 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.401 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 29.4 p -69.38 154.93 94.43 Favored Pre-proline 0 CA--C 1.53 0.191 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.399 178.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -85.25 -1.18 9.2 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.139 2.559 . . . . 0.0 112.511 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.974 179.977 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.484 0.917 0 N-CA-C 111.157 -0.363 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.412 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 32.9 p -74.12 140.57 76.92 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.052 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 69.5 Cg_endo -94.01 69.7 0.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.034 2.489 . . . . 0.0 112.031 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 35.85 65.32 0.43 Allowed 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.78 0.8 . . . . 0.0 111.515 -178.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 5.6 ttp -77.93 111.65 14.01 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.527 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -78.35 123.93 27.54 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.832 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.564 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.2 pt-20 -142.03 142.18 32.87 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.195 179.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -60.06 112.03 1.73 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.961 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.781 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.8 mt -106.14 99.05 8.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.528 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.637 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -100.23 96.73 7.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.137 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.49 -83.16 0.01 OUTLIER Glycine 0 C--N 1.321 -0.285 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.966 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.451 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.4 t-160 -64.43 -54.14 37.25 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.241 0.52 . . . . 0.0 111.475 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.445 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.5 m-70 -53.59 -39.06 64.55 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.781 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.5 t80 -65.47 -27.94 68.86 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 112.916 -1.947 . . . . 0.0 109.77 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.681 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.6 t -74.22 -68.01 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.388 -0.824 . . . . 0.0 108.847 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.568 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.4 OUTLIER -43.79 -57.83 3.04 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 123.25 0.344 . . . . 0.0 111.086 179.379 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.831 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.78 -51.82 59.13 Favored 'General case' 0 C--O 1.212 -0.893 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.301 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.637 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.33 -39.64 3.21 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.279 0.561 . . . . 0.0 110.476 -179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.643 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.2 OUTLIER -76.22 -64.57 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.073 179.29 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -34.45 -41.84 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.523 1.154 . . . . 0.0 110.051 177.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.868 HG22 ' HG2' ' A' ' 122' ' ' GLN . 68.3 t -73.78 -65.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 112.768 -2.014 . . . . 0.0 113.38 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 11.2 t -111.66 -42.24 3.88 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.603 -176.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.422 ' O ' ' C ' ' B' ' 48' ' ' GLY . . . 108.36 10.39 25.68 Favored Glycine 0 C--N 1.317 -0.483 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.932 -178.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' B' ' 47' ' ' GLY . . . 29.41 -134.01 0.07 OUTLIER Glycine 0 C--N 1.336 0.572 0 O-C-N 124.031 0.489 . . . . 0.0 113.298 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.526 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 59.1 Cg_endo -68.67 -135.09 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 122.709 2.273 . . . . 0.0 112.473 179.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -81.61 -55.64 4.53 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -178.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.681 ' CH2' HG13 ' B' ' 39' ' ' VAL . 38.5 m95 67.2 10.57 7.81 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.194 -177.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 74.2 m 60.45 175.67 0.1 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.971 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 23.3 p -154.65 -47.52 0.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.176 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -157.04 72.92 0.73 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.997 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.292 -0.861 . . . . 0.0 111.057 -179.924 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.853 0.359 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -155.38 21.78 0.41 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.207 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.15 -161.89 0.84 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.078 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.474 HG23 ' N ' ' A' ' 110' ' ' ASN . 14.1 t -75.66 -149.4 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.936 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.474 ' N ' HG23 ' A' ' 109' ' ' THR . 17.4 m120 -80.67 107.85 8.41 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.522 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 56.5 Cg_endo -66.07 -7.04 15.89 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.266 1.977 . . . . 0.0 112.297 -179.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.01 -42.25 9.54 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.998 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 25.5 ttt180 -77.86 -51.6 10.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.183 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.522 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -51.91 -35.94 47.28 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.719 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 74.3 m -79.0 -30.67 44.4 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.436 -0.506 . . . . 0.0 112.04 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.646 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.5 t -56.89 -45.46 82.57 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.574 -0.451 . . . . 0.0 110.006 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 19.5 mt -81.03 -38.94 26.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.316 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 11.5 t -106.66 -72.7 0.71 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.719 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.36 156.79 8.97 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.825 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -113.24 159.68 19.08 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.709 0.766 . . . . 0.0 112.233 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.703 ' O ' HD12 ' A' ' 125' ' ' LEU . 64.0 p -95.78 155.29 16.81 Favored 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 114.496 -1.229 . . . . 0.0 109.293 178.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.903 ' HG2' HG22 ' B' ' 45' ' ' VAL . 20.5 mt-30 -60.25 -3.28 0.59 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.726 ' O ' HG23 ' A' ' 127' ' ' THR . 47.6 mt-30 -87.86 -56.37 3.37 Favored 'General case' 0 N--CA 1.437 -1.109 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.595 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 17.8 t70 -53.1 -54.33 37.15 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.2 mt -56.94 -35.01 68.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.321 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.471 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.0 mt -64.07 -25.54 68.15 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-O 120.822 0.344 . . . . 0.0 110.162 178.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.726 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.2 p -97.14 -6.76 34.18 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.483 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.75 HD12 ' HA ' ' A' ' 125' ' ' LEU . 29.0 mt -91.78 -21.85 20.47 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.886 0.374 . . . . 0.0 110.536 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 31.2 p -69.75 154.27 94.88 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.501 178.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.453 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 2.4 Cg_endo -82.0 6.13 5.89 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 123.188 2.592 . . . . 0.0 112.244 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.899 -179.908 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo . . . . . 0 N--CA 1.484 0.918 0 N-CA-C 111.094 -0.387 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.406 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 65.7 p -74.22 127.28 88.1 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.987 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 94.4 Cg_endo -98.03 -159.18 0.05 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 123.189 2.593 . . . . 0.0 111.62 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -83.24 71.92 10.19 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.801 0.81 . . . . 0.0 110.016 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.2 tmm? -79.35 104.92 10.3 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.565 -179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 8.4 mtt180 -79.53 162.86 25.12 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.146 -1.388 . . . . 0.0 111.77 -179.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.464 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.8 pt-20 -166.75 137.22 3.2 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.628 0.728 . . . . 0.0 110.696 179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -62.99 112.4 2.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.534 -1.212 . . . . 0.0 112.183 -178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.829 HD13 ' HA ' ' B' ' 38' ' ' PHE . 31.4 mt -112.74 107.29 15.88 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.398 -1.274 . . . . 0.0 112.695 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.646 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -101.84 81.12 2.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.53 0.681 . . . . 0.0 111.206 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 65.09 -81.97 0.07 OUTLIER Glycine 0 C--N 1.321 -0.294 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.932 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -58.0 -56.08 26.61 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 117.315 0.558 . . . . 0.0 110.871 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -52.59 -46.53 66.97 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 177.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.829 ' HA ' HD13 ' B' ' 33' ' ' LEU . 24.7 t80 -54.26 -31.01 52.53 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 113.187 -1.824 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.703 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.2 t -72.83 -52.49 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.533 ' NE ' HG12 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -51.53 -65.04 0.63 Allowed 'General case' 0 CA--C 1.512 -0.494 0 O-C-N 123.61 0.569 . . . . 0.0 110.912 179.421 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.879 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.32 -45.88 55.09 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -47.05 -40.89 15.82 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.255 0.55 . . . . 0.0 109.813 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.703 HG23 ' O ' ' B' ' 39' ' ' VAL . 0.6 OUTLIER -73.48 -65.13 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.029 178.342 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -34.0 -41.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.086 177.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.903 HG22 ' HG2' ' A' ' 122' ' ' GLN . 78.5 t -74.5 -60.37 2.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 113.417 -1.72 . . . . 0.0 112.447 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 10.2 t -124.15 -57.71 1.58 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.68 -176.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.54 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 150.55 -95.85 0.16 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.966 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.453 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . 140.19 -135.79 7.32 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.165 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.591 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 57.9 Cg_endo -70.14 -68.39 0.02 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.72 2.28 . . . . 0.0 112.339 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.461 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 0.1 OUTLIER -158.62 -42.43 0.06 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.697 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.686 ' CH2' HG13 ' B' ' 39' ' ' VAL . 14.1 m95 64.1 -1.4 0.7 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.184 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 4.3 m -115.87 112.76 22.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.738 0.304 . . . . 0.0 110.783 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 12.3 p -156.59 -45.8 0.07 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.015 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -150.8 -176.33 5.48 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.562 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.105 179.988 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.785 0.326 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -83.53 132.08 34.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.973 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.53 -159.28 0.7 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.166 0.507 . . . . 0.0 111.409 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.444 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 12.7 t -75.29 -157.76 0.07 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.087 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -82.35 105.08 4.08 Favored Pre-proline 0 C--N 1.327 -0.405 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.6 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 56.9 Cg_endo -65.42 2.25 1.63 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.351 2.034 . . . . 0.0 113.335 -178.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.46 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -89.66 -52.36 5.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.367 0.604 . . . . 0.0 109.713 178.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -77.18 -24.95 51.38 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.194 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.6 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -63.83 -54.91 27.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.473 179.382 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.578 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.7 m -74.82 -14.13 60.65 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.586 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.612 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.0 t -76.91 -28.16 55.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.032 0.444 . . . . 0.0 110.075 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.0 mt -81.11 -34.44 32.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.699 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.442 ' HB3' ' NH1' ' B' ' 30' ' ' ARG . 3.1 m -138.33 -36.09 0.59 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.417 ' CA ' ' HA ' ' B' ' 32' ' ' LYS . . . 118.36 171.74 15.34 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.763 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.659 ' HB2' HD12 ' B' ' 33' ' ' LEU . 71.2 m -140.58 138.38 34.41 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.287 0.565 . . . . 0.0 112.463 -179.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.745 HG23 ' HG3' ' B' ' 30' ' ' ARG . 74.2 p -77.25 157.88 30.58 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.501 179.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.886 ' HG2' HG22 ' B' ' 45' ' ' VAL . 15.8 mt-30 -53.57 -20.63 5.3 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.614 ' O ' HG23 ' A' ' 127' ' ' THR . 21.7 mt-30 -70.53 -54.02 13.82 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.591 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -53.94 -53.03 58.45 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 178.258 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.722 HD21 HD13 ' B' ' 33' ' ' LEU . 1.1 mt -61.12 -30.72 70.54 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.629 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 7.0 mt -63.44 -27.17 69.1 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.614 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.5 OUTLIER -92.38 -16.0 26.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.902 179.759 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 14.5 mt -96.62 -1.43 46.85 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 121.561 0.696 . . . . 0.0 109.267 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.564 ' N ' ' CD ' ' A' ' 130' ' ' PRO . 36.7 t -56.73 -44.24 99.68 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 114.647 -1.16 . . . . 0.0 112.503 179.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 129' ' ' CYS . 60.1 Cg_endo -86.65 6.68 5.27 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.712 2.941 . . . . 0.0 112.325 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.926 179.857 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo . . . . . 0 N--CA 1.484 0.96 0 N-CA-C 111.168 -0.358 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 70.8 p -73.53 120.18 79.79 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.02 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -96.8 -157.41 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.124 2.549 . . . . 0.0 111.829 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.518 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 3.3 pt-20 -80.97 78.64 7.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.639 0.733 . . . . 0.0 110.046 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 46.7 ttm -83.47 10.91 7.78 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.191 -178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.745 ' HG3' HG23 ' A' ' 121' ' ' THR . 0.2 OUTLIER 37.67 34.78 0.06 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.405 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.409 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.8 pt-20 -66.06 155.83 35.59 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.42 0.628 . . . . 0.0 110.858 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.417 ' HA ' ' CA ' ' A' ' 119' ' ' GLY . 13.9 mtpt -63.16 108.2 1.21 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.83 -1.077 . . . . 0.0 112.625 -178.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.788 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 9.7 mt -101.91 98.86 9.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.535 -1.212 . . . . 0.0 110.959 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.612 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.7 t -99.83 94.09 6.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.251 0.548 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.11 -83.4 0.02 OUTLIER Glycine 0 C--N 1.321 -0.264 0 CA-C-N 115.029 -0.987 . . . . 0.0 112.991 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -60.19 -57.3 13.38 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.91 0.355 . . . . 0.0 111.493 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 8.2 m170 -52.96 -44.73 67.35 Favored 'General case' 0 CA--C 1.495 -1.163 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.788 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 20.2 t80 -57.7 -28.99 64.32 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.897 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.711 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.0 OUTLIER -74.15 -60.22 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.968 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.145 177.815 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.542 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.5 OUTLIER -49.43 -64.34 0.84 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 119.414 -0.327 . . . . 0.0 110.632 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.882 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -46.05 -49.23 16.55 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.498 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.625 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.56 -41.0 6.16 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.322 0.582 . . . . 0.0 110.431 179.883 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.673 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -79.84 -59.74 2.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.489 179.595 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . 0.435 ' HE ' ' HB3' ' B' ' 40' ' ' ARG . 4.8 mtt180 -36.22 -39.37 0.18 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.104 0.954 . . . . 0.0 109.335 177.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.886 HG22 ' HG2' ' A' ' 122' ' ' GLN . 59.8 t -76.02 -53.17 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 113.538 -1.664 . . . . 0.0 111.387 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 45.6 t -147.38 -63.98 0.27 Allowed 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.271 -177.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.673 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 143.75 124.91 1.86 Allowed Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 115.035 -0.984 . . . . 0.0 112.123 -177.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.686 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . -66.81 -119.31 0.02 OUTLIER Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.27 -0.491 . . . . 0.0 113.511 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.563 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 63.9 Cg_endo -70.72 -72.05 0.02 OUTLIER 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 123.555 2.836 . . . . 0.0 114.294 -178.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.475 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 35.3 mmt180 -152.39 -38.25 0.11 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.715 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.711 ' CH2' HG13 ' B' ' 39' ' ' VAL . 7.8 m95 62.12 9.21 3.01 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.09 178.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 37.5 m -138.27 142.07 39.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.752 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 23.5 p -154.73 -59.43 0.11 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.917 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -82.48 13.16 3.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.344 -0.836 . . . . 0.0 111.117 179.949 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.828 0.347 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.09 -77.68 0.49 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.213 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -131.55 -161.28 1.12 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.246 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.47 HG23 ' N ' ' A' ' 110' ' ' ASN . 9.2 t -76.36 -137.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.417 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.47 ' N ' HG23 ' A' ' 109' ' ' THR . 4.7 m120 -81.77 109.42 14.81 Favored Pre-proline 0 C--N 1.331 -0.224 0 N-CA-C 110.577 -0.157 . . . . 0.0 110.577 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.478 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 64.6 Cg_endo -71.32 88.61 0.72 Allowed 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.031 1.82 . . . . 0.0 111.631 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 164.85 -57.15 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.139 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.07 -34.34 59.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.335 179.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.452 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -62.19 -29.26 70.25 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.334 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.715 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 60.3 m -84.01 -33.91 24.42 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.813 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.596 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 46.6 t -54.9 -35.5 64.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 178.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 44.2 mt -82.4 -53.72 5.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.092 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.47 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 58.3 m -106.91 -58.46 1.93 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.715 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 128.64 174.22 13.67 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.372 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.999 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -133.13 155.17 49.77 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 117.376 0.588 . . . . 0.0 111.701 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.69 ' O ' HD12 ' A' ' 125' ' ' LEU . 67.8 p -97.71 159.94 14.62 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.524 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.815 ' HG2' HG22 ' B' ' 45' ' ' VAL . 16.3 mt-30 -62.13 2.67 0.22 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.632 ' O ' HG23 ' A' ' 127' ' ' THR . 19.9 mt-30 -94.92 -57.01 2.56 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.495 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 2.7 m-20 -55.41 -51.0 68.31 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mt -59.04 -34.73 72.25 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.097 179.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.481 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.4 mt -63.24 -30.35 71.51 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-O 120.745 0.307 . . . . 0.0 110.796 178.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.632 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -94.43 -5.46 46.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.519 -179.613 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.5 HD13 ' HZ ' ' B' ' 38' ' ' PHE . 95.5 mt -95.82 -20.57 18.72 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.799 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 24.7 p -58.42 148.42 64.67 Favored Pre-proline 0 C--N 1.332 -0.157 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.678 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.491 ' HG2' ' HB3' ' B' ' 49' ' ' PRO . 2.7 Cg_exo -76.46 -7.0 17.58 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 123.06 2.507 . . . . 0.0 112.553 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.935 179.951 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo . . . . . 0 N--CA 1.483 0.899 0 N-CA-C 111.225 -0.337 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 4.7 t -166.05 141.94 4.09 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.031 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 90.6 Cg_endo -97.8 -158.56 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.196 2.597 . . . . 0.0 112.293 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.473 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 2.8 pt-20 -81.95 77.77 8.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.606 0.717 . . . . 0.0 110.478 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 20.7 ttt -86.61 19.81 2.74 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.617 -1.174 . . . . 0.0 111.816 -179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.579 ' HG2' ' CG2' ' A' ' 121' ' ' THR . 0.0 OUTLIER 40.1 35.05 0.23 Allowed 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.07 179.377 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.494 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.9 pt-20 -64.97 152.45 43.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.526 0.679 . . . . 0.0 111.892 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 118' ' ' SER . 81.6 mttt -65.64 109.59 2.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.204 -1.362 . . . . 0.0 112.799 -177.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.999 HD12 ' SG ' ' A' ' 120' ' ' CYS . 58.7 mt -105.78 96.61 6.61 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.537 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.596 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.8 t -92.23 84.44 5.22 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.351 -179.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 63.11 -77.79 0.03 OUTLIER Glycine 0 C--N 1.32 -0.35 0 CA-C-N 114.947 -1.024 . . . . 0.0 112.976 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.485 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 3.9 t-160 -65.1 -52.46 55.3 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 117.32 0.56 . . . . 0.0 111.054 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.529 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 11.6 m170 -55.23 -35.32 64.81 Favored 'General case' 0 CA--C 1.498 -1.052 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.774 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 47.0 t80 -69.5 -26.42 64.53 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-N 113.007 -1.906 . . . . 0.0 109.664 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.648 ' O ' HG23 ' B' ' 43' ' ' VAL . 2.3 t -73.71 -68.33 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 176.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.526 ' N ' HG12 ' B' ' 39' ' ' VAL . 2.4 mpt_? -43.76 -55.11 4.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.525 0.516 . . . . 0.0 110.942 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.925 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -56.12 -49.35 74.15 Favored 'General case' 0 C--O 1.212 -0.876 0 C-N-CA 119.563 -0.855 . . . . 0.0 109.084 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -45.45 -40.88 8.8 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 121.469 0.652 . . . . 0.0 110.104 -179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.69 HG13 ' NE1' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -71.18 -62.02 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.907 178.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 4.9 mtt180 -38.68 -38.33 0.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 122.337 1.065 . . . . 0.0 109.759 177.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.925 HG23 ' O ' ' B' ' 41' ' ' ALA . 58.5 t -76.18 -63.38 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 113.072 -1.877 . . . . 0.0 114.024 -178.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 7.8 t -112.9 -35.29 5.49 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.54 -176.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.549 ' C ' ' HE1' ' B' ' 51' ' ' TRP . . . 105.05 18.21 12.68 Favored Glycine 0 C--N 1.318 -0.421 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.757 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 40.87 -152.83 0.09 OUTLIER Glycine 0 CA--C 1.521 0.431 0 N-CA-C 114.015 0.366 . . . . 0.0 114.015 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.5 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 57.5 Cg_endo -84.67 47.72 2.22 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.072 2.515 . . . . 0.0 113.046 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 67.37 -23.63 0.11 Allowed 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.69 ' NE1' HG13 ' B' ' 43' ' ' VAL . 16.5 m95 56.91 15.22 2.19 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 178.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 51.1 m -52.57 165.77 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.053 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 32.8 p -154.16 -41.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.058 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -82.25 -167.71 1.68 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.381 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.068 -179.886 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.871 0.367 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -160.64 133.58 6.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.023 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.13 -164.84 1.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.201 0.525 . . . . 0.0 111.399 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.442 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 13.5 t -76.77 -156.71 0.08 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.044 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -83.0 103.88 3.04 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.62 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 43.2 Cg_endo -63.11 -1.65 3.09 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.396 2.064 . . . . 0.0 113.357 -178.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.464 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -85.87 -52.91 5.43 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.403 0.62 . . . . 0.0 109.617 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.65 -26.0 50.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.959 -1.019 . . . . 0.0 109.474 178.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.62 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -63.16 -56.24 18.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.571 179.494 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.629 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.5 m -72.98 -29.17 62.85 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.791 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.637 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.5 t -57.44 -37.58 73.03 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.876 0.369 . . . . 0.0 110.729 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 14.3 mt -79.58 -56.44 4.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.833 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 58.9 m -105.27 -43.16 5.07 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.418 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 115.01 160.67 12.92 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.386 -178.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.43 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.9 m -131.21 148.17 52.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.307 0.575 . . . . 0.0 112.534 -179.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.829 ' O ' HD12 ' A' ' 125' ' ' LEU . 12.3 p -85.44 164.47 17.86 Favored 'General case' 0 CA--C 1.503 -0.83 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.038 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.895 ' HG2' HG22 ' B' ' 45' ' ' VAL . 40.8 mt-30 -63.11 -3.68 1.9 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.213 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.632 ' O ' HG23 ' A' ' 127' ' ' THR . 11.8 mm-40 -87.87 -54.28 4.32 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 176.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.6 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.49 -54.07 48.47 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.389 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.829 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -57.46 -32.8 67.3 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.533 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.479 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.8 mt -64.13 -27.99 69.46 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.852 0.358 . . . . 0.0 110.11 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.632 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -94.9 -7.35 40.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.232 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.623 HD12 ' HA ' ' A' ' 125' ' ' LEU . 34.5 mt -93.14 -17.97 23.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.759 0.314 . . . . 0.0 110.521 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 19.4 p -73.61 161.51 78.54 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.392 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.8 18.31 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.928 2.419 . . . . 0.0 112.479 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.149 -0.929 . . . . 0.0 110.887 179.864 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo . . . . . 0 N--CA 1.484 0.956 0 N-CA-C 111.244 -0.329 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 9.7 p 62.85 141.41 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.256 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.549 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 89.0 Cg_endo -93.51 -157.73 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.056 2.504 . . . . 0.0 111.835 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.57 64.26 6.21 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-O 121.787 0.804 . . . . 0.0 110.625 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 2.3 mtp -79.36 106.28 11.28 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.937 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 3.5 mtt180 -78.19 122.01 25.1 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.781 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.56 ' HG3' HD21 ' B' ' 33' ' ' LEU . 9.1 pt-20 -138.37 144.66 40.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.201 179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -62.73 112.58 2.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.123 -0.944 . . . . 0.0 112.923 -177.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.793 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 4.8 mt -106.42 99.68 9.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.421 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.637 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -99.98 98.74 9.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.395 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 56.66 -83.27 0.01 OUTLIER Glycine 0 C--N 1.322 -0.242 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.057 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.446 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.3 t-160 -63.4 -55.14 26.78 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 117.281 0.541 . . . . 0.0 111.439 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -53.06 -42.84 66.21 Favored 'General case' 0 CA--C 1.498 -1.049 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.793 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 19.7 t80 -60.09 -30.58 69.34 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.001 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.723 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.4 t -72.76 -64.2 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 177.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.604 ' HE ' HG12 ' B' ' 39' ' ' VAL . 0.0 OUTLIER -42.71 -62.63 0.95 Allowed 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 123.617 0.573 . . . . 0.0 110.634 179.065 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.846 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.0 -52.72 40.0 Favored 'General case' 0 C--O 1.21 -0.975 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.233 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.79 -38.81 3.43 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.042 0.448 . . . . 0.0 110.439 -179.88 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.666 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -76.98 -64.4 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.055 179.058 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 -33.83 -43.56 0.14 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 122.468 1.128 . . . . 0.0 110.136 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.895 HG22 ' HG2' ' A' ' 122' ' ' GLN . 57.3 t -72.47 -58.86 4.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 112.799 -2.001 . . . . 0.0 112.676 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.5 t -127.54 -59.42 1.22 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.508 -176.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.535 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 154.96 -106.9 0.3 Allowed Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.679 -178.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.411 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 150.62 -144.56 11.99 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.437 -0.887 . . . . 0.0 112.447 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.553 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 95.9 Cg_endo -80.06 38.13 0.72 Allowed 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.702 2.268 . . . . 0.0 112.225 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 72.15 -27.06 0.18 Allowed 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.891 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.723 ' CH2' HG13 ' B' ' 39' ' ' VAL . 12.4 m95 62.61 129.21 0.01 OUTLIER 'General case' 0 N--CA 1.436 -1.165 0 CA-C-O 121.942 0.877 . . . . 0.0 112.575 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . 0.423 ' O ' HG23 ' B' ' 53' ' ' THR . 68.3 m 62.01 148.84 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.022 -1.444 . . . . 0.0 111.506 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.423 HG23 ' O ' ' B' ' 52' ' ' SER . 0.8 OUTLIER -158.96 -56.61 0.07 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.096 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 45.06 46.91 9.61 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.329 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.128 -179.897 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.853 0.358 . . . . 0.0 110.995 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -160.69 23.89 0.15 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -128.89 -161.0 1.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.162 0.506 . . . . 0.0 111.298 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.5 t -76.97 -159.86 0.14 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.874 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -82.68 104.9 3.99 Favored Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.663 ' HA ' ' HB3' ' A' ' 114' ' ' TYR . 33.9 Cg_endo -59.62 -21.31 61.97 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.296 1.997 . . . . 0.0 113.178 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.469 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -67.52 -53.96 24.13 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.237 0.541 . . . . 0.0 110.417 179.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.54 -21.35 52.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.566 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.663 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -71.02 -51.29 26.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.983 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.587 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.4 m -74.56 -19.09 60.46 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.113 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.64 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 42.3 t -71.12 -48.58 51.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.786 0.326 . . . . 0.0 111.164 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.1 mt -80.85 -15.08 57.3 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.351 0.501 . . . . 0.0 112.351 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 47.8 t -134.44 -52.73 0.82 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.494 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 115.69 147.78 9.12 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.668 -0.777 . . . . 0.0 111.448 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.628 ' HB2' HD12 ' B' ' 33' ' ' LEU . 95.4 m -122.67 140.7 52.56 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.733 ' O ' HD12 ' A' ' 125' ' ' LEU . 75.3 p -76.72 155.51 33.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 114.337 -1.301 . . . . 0.0 109.756 178.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.891 ' HG2' HG22 ' B' ' 45' ' ' VAL . 20.2 mt-30 -55.15 -20.25 9.75 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 177.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.57 ' O ' HG23 ' A' ' 127' ' ' THR . 6.9 mp0 -69.84 -51.83 30.1 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.622 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -54.63 -57.11 12.72 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 178.019 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.741 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -56.21 -30.75 62.75 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.64 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.2 mt -62.88 -31.71 72.81 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.069 0.461 . . . . 0.0 109.847 178.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.57 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -100.54 -1.44 35.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.707 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 72.7 mt -93.31 -19.32 21.47 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.129 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.459 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 17.2 p -73.28 162.26 75.26 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.253 178.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.503 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 6.8 Cg_exo -74.46 -72.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.725 2.283 . . . . 0.0 112.212 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 . . . . . 0 C--O 1.249 1.046 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.907 179.992 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . 0.483 ' O ' HG23 ' B' ' 26' ' ' THR . 3.5 Cg_endo . . . . . 0 N--CA 1.483 0.901 0 N-CA-C 111.145 -0.367 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.483 HG23 ' O ' ' B' ' 25' ' ' PRO . 3.2 p -160.9 143.1 9.29 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.727 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -89.01 -158.73 0.08 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.647 2.232 . . . . 0.0 111.887 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.44 ' HB3' ' OE1' ' A' ' 123' ' ' GLN . 5.8 pt-20 -82.2 64.38 6.83 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.861 0.838 . . . . 0.0 110.645 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 22.9 ttt -83.77 12.28 6.22 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.344 -1.298 . . . . 0.0 110.864 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.566 ' NH1' ' HA ' ' A' ' 120' ' ' CYS . 1.3 mtt-85 51.3 173.53 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.12 -0.946 . . . . 0.0 112.678 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.557 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.3 tp10 173.89 139.4 0.04 OUTLIER 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.978 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 60.4 mttt -68.14 101.99 1.26 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.431 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.77 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.5 mt -99.91 98.44 9.22 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.42 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.9 t -98.71 94.57 6.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.167 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 60.49 -80.6 0.01 OUTLIER Glycine 0 C--N 1.32 -0.357 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.901 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 3.5 t-160 -65.98 -55.24 17.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.184 0.492 . . . . 0.0 111.494 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.459 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -53.14 -36.85 61.28 Favored 'General case' 0 CA--C 1.5 -0.978 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 177.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.77 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 21.9 t80 -67.72 -29.22 68.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 112.988 -1.914 . . . . 0.0 109.822 179.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.701 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.5 t -73.11 -65.61 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.387 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.52 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.9 OUTLIER -48.34 -58.6 4.37 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 119.204 -0.426 . . . . 0.0 110.934 179.221 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.8 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.53 -47.07 57.69 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.519 -179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.628 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.17 -39.24 13.35 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.205 0.526 . . . . 0.0 110.275 179.582 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.746 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -79.76 -62.48 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.382 179.697 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mtt180 -32.25 -40.8 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.437 1.113 . . . . 0.0 108.866 176.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.891 HG22 ' HG2' ' A' ' 122' ' ' GLN . 91.2 t -74.93 -66.43 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 112.949 -1.932 . . . . 0.0 112.215 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 47.7 t -127.79 -62.08 1.09 Allowed 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.057 -175.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.746 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 126.41 112.16 1.79 Allowed Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.611 -178.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.503 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . -62.25 -117.65 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 121.057 -0.592 . . . . 0.0 111.998 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.65 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 55.8 Cg_endo -68.74 -137.9 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.768 2.312 . . . . 0.0 111.516 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.443 ' H ' ' HB2' ' B' ' 49' ' ' PRO . 22.5 mmm180 -85.26 -40.09 17.0 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.701 ' CH2' HG13 ' B' ' 39' ' ' VAL . 37.2 m95 70.74 -21.76 0.19 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -179.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . 0.432 ' H ' ' C ' ' B' ' 50' ' ' ARG . 11.4 m -140.17 118.5 12.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.872 0.368 . . . . 0.0 110.968 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.92 -70.51 0.07 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.081 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -83.49 5.83 22.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.298 -179.839 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.799 0.333 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.41 154.93 24.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.016 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -135.59 -155.27 0.63 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.228 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.491 HG23 ' N ' ' A' ' 110' ' ' ASN . 14.8 t -75.53 -143.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.264 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.491 ' N ' HG23 ' A' ' 109' ' ' THR . 16.4 m120 -78.46 113.28 32.96 Favored Pre-proline 0 C--N 1.33 -0.255 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.585 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 62.1 Cg_endo -69.07 -8.68 24.26 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.276 1.984 . . . . 0.0 112.923 -178.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -94.24 -39.28 10.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.292 0.568 . . . . 0.0 110.966 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -77.49 -52.3 9.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.334 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.585 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -54.8 -31.59 59.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.732 -178.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.725 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 68.1 m -79.92 -22.18 43.03 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.956 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.627 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.8 t -70.6 -33.94 71.6 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 11.4 mt -84.12 -24.72 30.15 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.155 178.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.474 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 78.1 p -136.58 -63.04 0.64 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.753 -179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.725 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.21 156.11 8.76 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.761 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.968 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -107.96 155.85 19.87 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-O 121.666 0.746 . . . . 0.0 112.213 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.674 ' O ' HD12 ' A' ' 125' ' ' LEU . 32.7 p -94.84 151.27 19.37 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.441 178.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.919 ' HG2' HG22 ' B' ' 45' ' ' VAL . 9.9 mt-30 -56.56 -8.07 0.5 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.611 ' O ' HG23 ' A' ' 127' ' ' THR . 3.9 mm100 -83.46 -54.96 4.58 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.554 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 1.7 t70 -54.27 -54.71 36.39 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.674 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mt -56.67 -34.01 66.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.595 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.442 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.9 mt -62.89 -29.57 70.87 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.919 0.39 . . . . 0.0 110.572 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -99.75 -2.08 36.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.386 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.572 HD12 ' HA ' ' A' ' 125' ' ' LEU . 72.0 mt -92.96 -23.33 18.75 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.727 0.299 . . . . 0.0 110.694 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 25.2 p -62.72 146.07 94.94 Favored Pre-proline 0 C--O 1.232 0.137 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.419 178.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 129' ' ' CYS . 1.2 Cg_endo -84.69 -76.32 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.456 2.771 . . . . 0.0 112.537 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.34 -0.838 . . . . 0.0 110.919 179.927 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . 0.492 ' O ' HG23 ' B' ' 26' ' ' THR . 1.7 Cg_endo . . . . . 0 N--CA 1.483 0.909 0 N-CA-C 111.168 -0.358 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.492 HG23 ' O ' ' B' ' 25' ' ' PRO . 1.1 p -161.78 133.64 4.09 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.917 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 91.4 Cg_endo -96.45 -156.05 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.251 2.634 . . . . 0.0 112.08 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.537 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 3.3 pt-20 -80.14 78.76 6.77 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.595 0.712 . . . . 0.0 110.251 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.431 ' O ' ' HG3' ' B' ' 29' ' ' MET . 6.0 tpt -84.95 9.97 13.04 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.684 -1.143 . . . . 0.0 111.494 -179.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.662 ' HG3' HG23 ' A' ' 121' ' ' THR . 0.0 OUTLIER 37.54 91.59 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.227 178.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.63 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 4.7 tp10 -110.06 150.28 28.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.234 0.54 . . . . 0.0 111.265 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 118' ' ' SER . 4.0 mtpm? -63.24 100.02 0.21 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.62 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.968 HD12 ' SG ' ' A' ' 120' ' ' CYS . 63.4 mt -100.24 102.25 13.48 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.826 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.627 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.1 t -98.14 76.86 2.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.361 0.6 . . . . 0.0 111.223 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.27 -75.61 0.5 Allowed Glycine 0 C--N 1.319 -0.373 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.857 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.46 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 5.2 t-160 -66.63 -53.17 37.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.496 0.648 . . . . 0.0 110.841 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.5 m170 -53.7 -38.17 63.99 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.802 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 37.8 t80 -64.75 -30.25 71.26 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.037 -1.892 . . . . 0.0 109.835 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.685 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.5 t -71.09 -66.32 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.562 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -46.26 -61.35 1.82 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 119.38 -0.343 . . . . 0.0 110.408 178.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.863 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -48.35 -50.14 31.61 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.513 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.679 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -45.16 -41.56 8.21 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.3 0.571 . . . . 0.0 110.067 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.672 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -74.81 -64.62 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.191 179.165 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 5.5 mtt180 -33.28 -41.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 122.289 1.042 . . . . 0.0 109.86 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.919 HG22 ' HG2' ' A' ' 122' ' ' GLN . 59.3 t -74.05 -58.54 4.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 113.277 -1.783 . . . . 0.0 112.561 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 22.2 t -129.89 -60.21 1.04 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.277 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.656 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 126.57 116.25 2.03 Favored Glycine 0 C--N 1.321 -0.303 0 CA-C-N 114.723 -1.126 . . . . 0.0 111.445 -177.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.686 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . -61.87 -125.25 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.36 -0.447 . . . . 0.0 113.736 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.498 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 60.5 Cg_endo -69.38 -69.24 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 123.116 2.544 . . . . 0.0 113.004 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.491 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 0.2 OUTLIER -156.56 -39.93 0.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.931 -179.915 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.686 ' HE1' ' N ' ' B' ' 48' ' ' GLY . 11.2 m95 69.52 -67.32 0.23 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.208 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . 0.404 ' H ' ' H ' ' B' ' 53' ' ' THR . 63.8 m -158.65 -11.79 0.07 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.924 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.404 ' H ' ' H ' ' B' ' 52' ' ' SER . 70.1 p -80.43 -47.42 14.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.277 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 46.54 69.42 0.49 Allowed 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.256 -179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.082 -179.925 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.875 0.369 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -149.26 -178.17 6.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.944 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 59.36 -175.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.513 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.541 HG23 ' H ' ' A' ' 110' ' ' ASN . 0.8 OUTLIER -163.25 -53.19 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.241 -179.726 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.541 ' H ' HG23 ' A' ' 109' ' ' THR . 1.6 m120 -158.21 82.73 2.78 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.195 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 17.8 Cg_endo -53.62 90.9 0.03 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.334 2.023 . . . . 0.0 111.762 -178.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 156.47 -62.09 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 113.998 -1.455 . . . . 0.0 107.434 -178.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.84 -18.8 53.43 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.407 -1.269 . . . . 0.0 107.951 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.483 ' HB2' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -72.55 -56.25 5.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 113.475 -1.693 . . . . 0.0 110.857 -179.585 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.612 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.6 m -74.35 -21.73 59.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.904 0.383 . . . . 0.0 110.923 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.653 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.7 t -68.99 -47.85 64.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.9 0.381 . . . . 0.0 110.903 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 13.2 mt -81.8 -17.5 47.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.287 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 t -132.21 -54.79 0.97 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -179.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.565 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 116.95 149.21 9.02 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.642 -0.79 . . . . 0.0 111.509 -178.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.539 ' HA ' HH11 ' B' ' 30' ' ' ARG . 78.0 m -127.22 146.28 50.47 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -179.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.808 ' O ' HD12 ' A' ' 125' ' ' LEU . 65.9 p -87.23 165.06 15.97 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.833 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.842 ' HG2' HG22 ' B' ' 45' ' ' VAL . 14.3 mt-30 -61.68 -0.59 0.46 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 177.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.665 ' O ' HG23 ' A' ' 127' ' ' THR . 79.7 mt-30 -89.85 -54.37 4.08 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 176.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.53 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -57.99 -50.12 74.5 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.808 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mp -60.48 -31.72 70.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.24 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.452 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.2 mt -64.55 -28.43 69.64 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-O 120.961 0.41 . . . . 0.0 110.007 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.665 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -95.58 -5.57 42.3 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.501 -179.795 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 44.5 mt -96.44 -18.62 19.75 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.175 -179.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.459 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 32.0 p -67.91 150.66 97.68 Favored Pre-proline 0 C--N 1.331 -0.206 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.527 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 129' ' ' CYS . 1.4 Cg_endo -85.69 -7.51 8.53 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.283 2.655 . . . . 0.0 112.36 -179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.892 -179.916 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 N--CA 1.484 0.937 0 N-CA-C 111.067 -0.397 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.9 t -166.49 144.24 4.38 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.385 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -93.03 -156.08 0.05 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.202 2.602 . . . . 0.0 112.057 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' B' ' 30' ' ' ARG . 12.6 mm-40 -78.49 -14.51 59.33 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 121.835 0.826 . . . . 0.0 110.249 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . 0.46 ' HG2' ' O ' ' B' ' 29' ' ' MET . 53.5 ttm 37.02 26.01 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.551 -1.658 . . . . 0.0 112.647 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.594 ' CD ' HG23 ' A' ' 121' ' ' THR . 7.7 mmt180 46.29 -158.07 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.753 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.631 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.2 tp10 175.85 132.83 0.04 OUTLIER 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.691 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 57.6 mttt -65.92 102.42 0.78 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.565 0.698 . . . . 0.0 112.133 -178.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.769 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.0 mt -103.94 100.38 10.16 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.638 -1.165 . . . . 0.0 111.581 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.653 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -99.9 92.28 5.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.88 -80.25 0.02 OUTLIER Glycine 0 C--N 1.322 -0.235 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.889 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.498 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 4.1 t-160 -65.19 -55.66 17.32 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 117.337 0.568 . . . . 0.0 111.182 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.455 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.7 m-70 -52.95 -37.53 61.15 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 177.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.769 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 25.4 t80 -67.14 -27.94 67.72 Favored 'General case' 0 N--CA 1.433 -1.295 0 CA-C-N 113.02 -1.9 . . . . 0.0 109.786 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.667 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.0 OUTLIER -74.46 -65.77 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.226 177.496 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.589 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -46.01 -57.97 3.97 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 119.385 -0.341 . . . . 0.0 110.848 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.882 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.0 -51.74 55.26 Favored 'General case' 0 C--O 1.212 -0.914 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.975 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.641 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -42.45 -38.06 1.79 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.281 0.562 . . . . 0.0 110.473 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.64 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.3 OUTLIER -77.31 -64.78 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.1 179.073 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 5.0 mtt180 -34.21 -40.8 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 122.464 1.126 . . . . 0.0 109.767 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.882 HG23 ' O ' ' B' ' 41' ' ' ALA . 60.8 t -74.51 -62.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 112.855 -1.975 . . . . 0.0 112.778 -179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 9.0 t -121.64 -58.94 1.73 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.538 -176.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.505 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 149.29 -101.51 0.22 Allowed Glycine 0 C--N 1.321 -0.281 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.961 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.496 ' CA ' ' HE1' ' B' ' 51' ' ' TRP . . . 139.1 -134.0 6.5 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.478 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.643 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 57.5 Cg_endo -69.49 -69.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.927 2.418 . . . . 0.0 113.149 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.433 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 0.5 OUTLIER -155.98 -45.66 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.073 0.463 . . . . 0.0 111.279 -179.038 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.667 ' CH2' HG13 ' B' ' 39' ' ' VAL . 16.5 m95 63.35 -1.79 0.52 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.578 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . 0.402 ' H ' ' C ' ' B' ' 50' ' ' ARG . 74.2 m 58.17 171.93 0.06 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.897 0.38 . . . . 0.0 111.419 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 21.1 p -155.59 -46.63 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.93 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -82.67 25.89 0.62 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.102 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.067 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.22 114.33 15.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.314 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -102.83 -159.73 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.709 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.476 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 14.7 t -74.99 -155.72 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.446 ' O ' ' HB3' ' A' ' 114' ' ' TYR . 2.3 m-20 -84.77 101.59 1.68 Allowed Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.476 ' HD3' ' O ' ' A' ' 109' ' ' THR . 41.8 Cg_endo -62.72 0.83 1.29 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.375 2.05 . . . . 0.0 112.989 -178.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.13 -49.62 5.91 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.448 0.642 . . . . 0.0 109.54 178.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.6 mmm180 -78.51 -23.86 46.1 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.911 178.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.462 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -70.08 -51.21 33.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.773 179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.571 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 4.5 m -75.49 -16.03 60.35 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.679 -0.409 . . . . 0.0 110.957 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.643 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 41.9 t -71.57 -53.02 15.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.857 0.361 . . . . 0.0 111.272 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.8 mt -79.84 -13.94 59.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.338 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.7 t -129.29 -55.63 1.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.462 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 114.4 144.11 8.5 Favored Glycine 0 N--CA 1.452 -0.265 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.565 ' HB2' HD12 ' B' ' 33' ' ' LEU . 89.8 m -122.03 142.59 50.17 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.748 ' O ' HD12 ' A' ' 125' ' ' LEU . 73.3 p -75.81 157.05 33.88 Favored 'General case' 0 CA--C 1.503 -0.854 0 CA-C-N 114.028 -1.442 . . . . 0.0 109.648 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.731 ' HG2' HG22 ' B' ' 45' ' ' VAL . 18.2 mt-30 -58.83 -14.46 8.92 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.627 ' O ' HG23 ' A' ' 127' ' ' THR . 26.6 mt-30 -74.31 -51.96 13.65 Favored 'General case' 0 N--CA 1.442 -0.868 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.628 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.4 OUTLIER -52.66 -57.39 10.22 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 177.977 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.756 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -54.36 -34.43 61.14 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.488 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.459 HD23 ' HB2' ' B' ' 46' ' ' CYS . 6.3 mt -60.76 -32.94 72.22 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.184 0.516 . . . . 0.0 110.001 178.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.627 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -90.94 -9.46 46.03 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.631 -179.565 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 27.5 mt -92.02 -13.42 30.99 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 120.965 0.412 . . . . 0.0 110.069 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.636 ' HA ' ' HA2' ' B' ' 48' ' ' GLY . 1.6 p -83.64 175.97 4.22 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.134 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.649 ' HD3' ' H ' ' B' ' 48' ' ' GLY . 16.4 Cg_exo -68.19 -159.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.383 2.055 . . . . 0.0 112.388 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.122 -179.995 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo . . . . . 0 N--CA 1.485 0.981 0 N-CA-C 110.957 -0.439 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 61.9 p -72.59 133.81 82.4 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.997 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -97.63 -157.17 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.316 2.677 . . . . 0.0 111.842 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -82.16 75.09 9.1 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.637 0.732 . . . . 0.0 110.433 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 16.6 ttm -80.18 114.93 19.45 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.827 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -79.7 163.07 24.82 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.021 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 5.5 tp10 -176.74 139.99 0.32 Allowed 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.937 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -67.42 101.84 1.03 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.387 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.718 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.2 mt -97.26 96.68 8.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.324 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.643 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.8 t -97.66 88.7 4.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.049 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.553 ' O ' HG23 ' B' ' 39' ' ' VAL . . . 64.22 -78.23 0.05 OUTLIER Glycine 0 C--N 1.318 -0.426 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.639 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.541 ' HA ' ' HB ' ' B' ' 39' ' ' VAL . 5.6 t-160 -66.37 -54.42 24.7 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 117.336 0.568 . . . . 0.0 111.659 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.493 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 6.8 m-70 -54.51 -34.26 61.35 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 177.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.718 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 27.3 t80 -71.68 -27.04 62.78 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.167 -1.833 . . . . 0.0 109.654 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.7 HG13 ' CH2' ' B' ' 51' ' ' TRP . 2.3 t -73.61 -62.53 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.615 178.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.441 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 0.2 OUTLIER -60.72 -42.48 97.35 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 118.891 -0.576 . . . . 0.0 112.022 179.272 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.748 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -61.03 -40.85 95.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 119.438 1.017 . . . . 0.0 109.225 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.612 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.6 -47.02 67.21 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.125 0.488 . . . . 0.0 111.28 179.834 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.608 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.1 OUTLIER -76.09 -49.24 26.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.174 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . 0.439 ' HD3' ' C ' ' B' ' 44' ' ' ARG . 0.0 OUTLIER -43.91 -40.58 4.67 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-O 122.864 1.316 . . . . 0.0 107.764 177.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.756 HG21 ' HB2' ' A' ' 125' ' ' LEU . 56.0 t -74.05 -62.66 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.338 0 CA-C-N 112.091 -2.322 . . . . 0.0 111.195 178.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.459 ' HB2' HD23 ' A' ' 126' ' ' LEU . 49.1 t -141.31 -60.73 0.48 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 113.917 -1.492 . . . . 0.0 111.927 -176.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.608 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 170.87 -90.53 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.46 -178.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.649 ' H ' ' HD3' ' A' ' 130' ' ' PRO . . . 123.12 -124.4 5.62 Favored Glycine 0 N--CA 1.445 -0.735 0 N-CA-C 111.471 -0.652 . . . . 0.0 111.471 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.583 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 38.2 Cg_endo -65.21 -140.38 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.877 2.384 . . . . 0.0 112.021 178.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.49 ' H ' ' HB2' ' B' ' 49' ' ' PRO . 79.7 mtt180 -80.96 -58.28 3.15 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.7 ' CH2' HG13 ' B' ' 39' ' ' VAL . 35.4 m95 71.76 -10.89 0.8 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.867 -178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . 0.4 ' H ' ' C ' ' B' ' 50' ' ' ARG . 56.1 m 62.51 143.07 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.451 -179.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 55.5 p -154.99 -41.92 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.042 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.86 24.59 0.73 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.224 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.022 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.269 0 CA-C-O 120.649 0.261 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 63.92 153.93 0.05 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.297 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -116.88 -167.17 1.25 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.25 0.547 . . . . 0.0 111.436 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 12.4 t -78.1 -161.53 0.27 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.108 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -82.71 106.2 6.37 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.497 ' HB2' ' CZ ' ' B' ' 38' ' ' PHE . 31.2 Cg_endo -60.13 -14.93 31.2 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.165 1.91 . . . . 0.0 112.812 -178.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.456 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -72.36 -49.17 36.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.254 0.549 . . . . 0.0 110.118 179.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.448 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.7 OUTLIER -78.3 -35.15 48.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.879 178.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.494 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -59.97 -56.66 18.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.135 179.842 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.572 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 9.3 m -69.38 -16.41 63.51 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.287 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.628 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 39.8 t -71.34 -46.72 59.9 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.599 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 9.0 mt -80.58 -16.59 53.76 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -178.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 80.5 p -133.68 -51.48 0.85 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.401 ' HA2' ' O ' ' A' ' 115' ' ' CYS . . . 117.98 160.85 11.75 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.521 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 92.1 m -136.89 143.46 43.0 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.766 ' O ' HD12 ' A' ' 125' ' ' LEU . 82.3 p -80.82 161.29 24.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.554 179.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.922 ' HG2' HG22 ' B' ' 45' ' ' VAL . 27.8 mt-30 -58.28 -15.17 9.17 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 177.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.654 ' O ' HG23 ' A' ' 127' ' ' THR . 25.5 mt-30 -73.77 -54.68 7.49 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.602 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -54.45 -55.33 29.94 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.848 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.766 HD12 ' O ' ' A' ' 121' ' ' THR . 1.1 mp -58.83 -31.08 68.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.965 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 6.8 mt -64.77 -27.6 69.01 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.866 0.365 . . . . 0.0 110.158 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -97.94 -6.52 32.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.266 179.859 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 40.7 mt -94.76 -16.2 23.22 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.748 0.309 . . . . 0.0 110.702 -179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 30.6 p -73.88 154.66 88.99 Favored Pre-proline 0 CA--C 1.529 0.152 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.775 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -81.48 17.34 1.51 Allowed 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.218 2.612 . . . . 0.0 112.465 -179.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.998 179.917 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 111.112 -0.38 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.405 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 4.1 t -165.42 143.13 4.91 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.112 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 98.0 Cg_endo -94.11 70.76 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.132 2.555 . . . . 0.0 112.17 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.456 ' OE2' ' HG3' ' A' ' 123' ' ' GLN . 1.3 mt-10 38.69 69.26 0.28 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.403 0.621 . . . . 0.0 111.535 -179.155 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 39.4 ttp -82.7 16.39 2.22 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.038 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 55.77 174.28 0.03 OUTLIER 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.162 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.578 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.0 tp10 -178.64 136.25 0.15 Allowed 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.399 -179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -64.65 102.54 0.58 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.793 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.772 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 34.2 mt -99.58 104.88 16.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.458 -1.246 . . . . 0.0 112.14 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.628 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.6 OUTLIER -103.26 95.31 6.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.447 0.641 . . . . 0.0 111.124 179.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 58.97 -87.66 0.02 OUTLIER Glycine 0 C--O 1.227 -0.299 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.17 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.497 ' O ' ' HG3' ' B' ' 40' ' ' ARG . 18.7 t-160 -59.02 -56.63 19.8 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 117.206 0.503 . . . . 0.0 111.597 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -48.74 -48.78 40.38 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.235 -1.395 . . . . 0.0 107.235 177.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.772 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 22.6 t80 -55.94 -31.28 62.8 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-N 112.994 -1.912 . . . . 0.0 110.424 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.704 ' O ' HG23 ' B' ' 43' ' ' VAL . 0.5 OUTLIER -72.79 -45.04 57.83 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.984 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.787 178.189 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' B' ' 36' ' ' HIS . 1.9 mtt180 -61.09 -61.03 2.87 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.879 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.825 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -52.68 -45.56 66.88 Favored 'General case' 0 C--O 1.208 -1.098 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -45.84 -38.65 7.53 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.349 0.595 . . . . 0.0 109.724 179.433 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.739 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.4 OUTLIER -76.72 -63.41 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.4 178.79 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.8 mtm180 -36.7 -40.62 0.27 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 122.439 1.114 . . . . 0.0 110.195 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.922 HG22 ' HG2' ' A' ' 122' ' ' GLN . 99.4 t -75.19 -65.55 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 112.949 -1.932 . . . . 0.0 113.4 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t -109.63 -38.2 5.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.613 -176.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.415 ' O ' ' C ' ' B' ' 48' ' ' GLY . . . 101.02 7.5 50.0 Favored Glycine 0 CA--C 1.506 -0.512 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.421 -178.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' B' ' 47' ' ' GLY . . . 28.91 -133.36 0.06 OUTLIER Glycine 0 C--N 1.335 0.519 0 O-C-N 124.083 0.52 . . . . 0.0 113.51 179.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.568 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 60.3 Cg_endo -69.65 -136.85 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.518 0 C-N-CA 122.926 2.417 . . . . 0.0 112.368 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.449 ' H ' ' HB2' ' B' ' 49' ' ' PRO . 32.6 mtt180 -81.78 -53.98 5.75 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -178.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.739 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 49.1 m95 71.2 1.42 3.82 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.157 -178.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 2.6 m -147.4 105.98 3.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.889 0.376 . . . . 0.0 111.099 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 15.3 p -156.86 82.75 0.95 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.828 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.86 -8.19 58.88 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.896 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.262 -0.875 . . . . 0.0 111.433 -179.945 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.796 0.331 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -132.65 165.67 23.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.204 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -133.34 -144.88 0.23 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.89 -179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.442 HG23 ' N ' ' A' ' 110' ' ' ASN . 9.7 t -74.79 -140.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.314 179.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.442 ' N ' HG23 ' A' ' 109' ' ' THR . 2.7 m-20 -79.69 112.62 30.74 Favored Pre-proline 0 C--N 1.328 -0.344 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.584 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 42.7 Cg_endo -64.57 -10.99 26.57 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.292 1.994 . . . . 0.0 112.817 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.28 -46.27 6.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.948 0.404 . . . . 0.0 111.706 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 113' ' ' ARG . 0.5 OUTLIER -76.89 -40.5 47.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.654 -179.528 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.584 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -59.83 -34.82 73.58 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.811 -179.39 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.783 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 73.5 m -77.5 -21.05 53.35 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.071 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.603 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 53.3 t -65.41 -43.4 90.7 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 20.9 mt -84.29 -20.71 31.69 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.215 178.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.514 ' O ' ' HG2' ' B' ' 32' ' ' LYS . 43.2 t -127.53 -75.86 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 111.364 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.783 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 132.76 155.03 7.73 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 121.152 -0.547 . . . . 0.0 112.124 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.983 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -114.48 149.75 35.87 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.538 0.685 . . . . 0.0 112.273 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.795 HG23 ' HG3' ' B' ' 30' ' ' ARG . 39.0 p -87.89 150.86 23.24 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.051 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.901 ' HG2' HG22 ' B' ' 45' ' ' VAL . 24.3 mt-30 -53.06 -19.22 2.58 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.525 ' O ' HG23 ' A' ' 127' ' ' THR . 0.0 OUTLIER -72.55 -53.61 11.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.503 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 6.0 t70 -55.1 -52.18 64.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.83 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.1 mt -59.01 -31.9 69.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.856 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.532 ' HG ' HG13 ' B' ' 45' ' ' VAL . 7.7 mt -63.3 -28.94 70.36 Favored 'General case' 0 C--O 1.231 0.095 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 178.052 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -98.09 -3.89 36.97 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.376 -179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.83 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.1 mt -91.24 -21.34 21.15 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.759 0.314 . . . . 0.0 110.444 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 2.9 p -79.22 166.11 44.02 Favored Pre-proline 0 C--O 1.232 0.14 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.14 178.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -81.3 -169.06 0.71 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.982 2.455 . . . . 0.0 111.956 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.312 -0.851 . . . . 0.0 111.233 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo . . . . . 0 N--CA 1.485 1.028 0 N-CA-C 111.344 -0.291 . . . . 0.0 111.344 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.422 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 68.0 p -73.74 135.93 77.58 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.901 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 96.8 Cg_endo -95.97 -159.31 0.05 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 123.043 2.495 . . . . 0.0 111.676 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.512 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 3.9 pt-20 -81.0 77.93 7.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.736 0.779 . . . . 0.0 110.324 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 39.7 ttp -83.28 15.55 2.89 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.865 -179.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.795 ' HG3' HG23 ' A' ' 121' ' ' THR . 0.0 OUTLIER 36.81 84.43 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.001 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.514 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.3 pt-20 -107.49 154.44 21.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.62 0.724 . . . . 0.0 111.325 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 118' ' ' SER . 79.8 mttt -60.19 104.94 0.36 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 114.288 -1.324 . . . . 0.0 112.604 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.983 HD12 ' SG ' ' A' ' 120' ' ' CYS . 63.9 mt -101.33 98.79 9.12 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.186 179.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.603 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 4.3 t -94.9 78.32 3.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.388 0.613 . . . . 0.0 111.19 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 67.43 -75.15 0.2 Allowed Glycine 0 C--N 1.32 -0.319 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.744 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.508 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.5 t-160 -65.81 -52.23 52.35 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 117.237 0.519 . . . . 0.0 110.912 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.528 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.8 m170 -55.44 -36.99 67.11 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 176.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.791 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 39.4 t80 -67.21 -27.3 67.14 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 112.987 -1.915 . . . . 0.0 109.683 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.711 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.6 t -73.13 -66.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.84 0 CA-C-N 115.118 -0.947 . . . . 0.0 108.811 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.546 ' N ' HG12 ' B' ' 39' ' ' VAL . 2.5 mpt_? -48.65 -59.64 3.37 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 119.267 -0.396 . . . . 0.0 110.461 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.845 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -48.45 -43.81 34.89 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.805 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.663 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -52.94 -42.85 65.84 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 121.033 0.444 . . . . 0.0 110.332 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.712 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -74.45 -59.5 3.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.128 179.214 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' B' ' 43' ' ' VAL . 1.9 mmm180 -33.56 -40.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.437 1.113 . . . . 0.0 108.504 176.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.901 HG22 ' HG2' ' A' ' 122' ' ' GLN . 75.0 t -75.84 -65.96 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 112.997 -1.91 . . . . 0.0 111.751 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 31.8 t -135.74 -61.67 0.71 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.225 -1.352 . . . . 0.0 111.671 -176.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.712 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 120.62 110.67 2.24 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.339 -0.846 . . . . 0.0 113.168 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.04 -97.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.954 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.654 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 77.1 Cg_endo -75.84 -161.07 0.12 Allowed 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.839 3.026 . . . . 0.0 110.987 178.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.42 -18.92 30.51 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.711 ' CH2' HG13 ' B' ' 39' ' ' VAL . 18.7 m95 62.38 6.45 1.92 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.881 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 4.6 m -113.96 112.31 23.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.903 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 19.0 p -155.38 81.62 1.05 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.943 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 45.45 -160.92 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.651 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.079 179.857 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.779 0.323 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -151.66 1.63 0.37 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.159 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -107.94 128.33 54.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.282 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.481 HG23 ' H ' ' A' ' 110' ' ' ASN . 0.1 OUTLIER 33.79 -99.07 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.331 -179.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.481 ' H ' HG23 ' A' ' 109' ' ' THR . 3.0 m120 -155.42 96.73 2.42 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.54 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.478 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 27.2 Cg_endo -58.74 89.85 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 121.984 1.789 . . . . 0.0 111.229 -179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 160.76 -63.34 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 114.52 -1.218 . . . . 0.0 107.841 -179.103 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -78.06 -16.46 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.979 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.409 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -73.25 -46.1 52.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 113.842 -1.526 . . . . 0.0 110.599 179.643 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.588 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 3.2 m -83.06 -20.64 34.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.391 . . . . 0.0 110.825 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.661 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 50.4 t -69.72 -50.31 44.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.921 0.391 . . . . 0.0 110.913 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.6 mt -80.95 -14.88 57.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.024 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 27.2 t -131.91 -59.23 0.95 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.584 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.3 147.48 7.89 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.78 -0.928 . . . . 0.0 110.78 -178.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.578 ' HB2' HD12 ' B' ' 33' ' ' LEU . 94.4 m -123.06 145.0 48.92 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.803 ' O ' HD12 ' A' ' 125' ' ' LEU . 39.9 p -82.21 157.91 23.77 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.742 179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.922 ' HG2' HG22 ' B' ' 45' ' ' VAL . 7.0 mt-30 -56.85 -18.61 13.67 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.69 ' O ' HG23 ' A' ' 127' ' ' THR . 47.2 mt-30 -72.15 -52.07 18.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.577 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.3 OUTLIER -54.62 -57.01 13.11 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.471 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.803 HD12 ' O ' ' A' ' 121' ' ' THR . 1.3 mp -59.26 -28.87 67.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.144 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.431 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 7.1 mt -66.79 -27.01 67.23 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.857 0.36 . . . . 0.0 110.084 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.2 OUTLIER -100.95 -3.73 28.96 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.354 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.678 HD12 ' HA ' ' A' ' 125' ' ' LEU . 28.2 mt -93.35 -20.79 20.02 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 120.854 0.359 . . . . 0.0 110.369 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.48 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 27.7 p -66.8 155.16 90.3 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.401 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.405 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 3.4 Cg_exo -77.4 160.57 32.18 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.115 2.543 . . . . 0.0 112.24 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.362 -0.828 . . . . 0.0 111.101 -179.885 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo . . . . . 0 N--CA 1.485 0.984 0 N-CA-C 111.475 -0.241 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.5 t -73.25 141.9 81.33 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.167 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -94.2 -160.04 0.07 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.124 2.55 . . . . 0.0 112.41 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.32 56.89 3.97 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.959 0.885 . . . . 0.0 111.493 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.76 110.77 9.32 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.771 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -75.6 161.42 29.14 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.19 -0.913 . . . . 0.0 112.095 -178.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 7.2 tp10 -169.36 141.87 2.57 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.788 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 12.7 mtpt -69.86 102.74 2.02 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-O 121.688 0.756 . . . . 0.0 111.612 -178.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.765 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 5.2 mt -100.91 101.59 12.44 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.386 -1.279 . . . . 0.0 111.743 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.661 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.6 t -98.6 91.25 5.05 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.305 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.419 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 59.72 -79.5 0.01 OUTLIER Glycine 0 C--N 1.321 -0.258 0 CA-C-N 114.856 -1.065 . . . . 0.0 112.914 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.477 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 3.4 t-160 -63.6 -54.94 28.08 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 117.106 0.453 . . . . 0.0 111.191 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.403 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 4.5 m-70 -54.96 -38.31 67.6 Favored 'General case' 0 CA--C 1.497 -1.059 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.765 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 26.5 t80 -65.25 -26.99 68.34 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 113.062 -1.881 . . . . 0.0 109.626 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.681 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.4 t -74.38 -65.11 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.561 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.1 OUTLIER -43.69 -62.37 1.12 Allowed 'General case' 0 CA--C 1.512 -0.484 0 O-C-N 123.259 0.349 . . . . 0.0 110.721 178.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.762 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.54 -50.85 52.27 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 119.807 -0.757 . . . . 0.0 109.032 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.669 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -42.39 -38.93 2.02 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.374 0.607 . . . . 0.0 110.267 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.652 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.3 OUTLIER -78.59 -67.58 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.272 178.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . 0.478 ' HG3' ' O ' ' B' ' 40' ' ' ARG . 10.0 mtt180 -32.26 -42.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 122.396 1.093 . . . . 0.0 110.35 177.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.922 HG22 ' HG2' ' A' ' 122' ' ' GLN . 92.5 t -73.04 -59.87 2.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 113.106 -1.861 . . . . 0.0 112.924 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.48 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 13.5 t -122.57 -52.79 1.91 Allowed 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.137 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.584 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 111.89 96.06 2.29 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.096 -177.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.665 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . -59.12 -133.53 0.01 OUTLIER Glycine 0 CA--C 1.523 0.581 0 C-N-CA 121.37 -0.443 . . . . 0.0 113.594 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.551 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 38.9 Cg_endo -85.79 104.29 0.77 Allowed 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.551 2.834 . . . . 0.0 114.781 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 51.51 -71.12 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 176.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.681 ' CH2' HG13 ' B' ' 39' ' ' VAL . 30.1 m95 73.23 4.64 4.93 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.058 0.543 . . . . 0.0 111.281 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 45.8 m -101.99 146.04 28.44 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.07 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -159.95 -57.21 0.06 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.185 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -81.95 39.1 0.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.987 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.371 -0.823 . . . . 0.0 111.275 -179.771 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.685 0.279 . . . . 0.0 111.036 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 63.35 111.22 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.446 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -103.26 -122.45 0.19 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.983 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.668 HG23 ' H ' ' A' ' 110' ' ' ASN . 1.3 t -159.67 -57.74 0.06 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.373 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.668 ' H ' HG23 ' A' ' 109' ' ' THR . 17.3 m120 -157.05 85.32 2.9 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.339 179.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.631 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 39.5 Cg_endo -60.37 -8.46 8.71 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.516 2.144 . . . . 0.0 113.424 -177.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -90.34 -44.97 9.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.397 0.618 . . . . 0.0 110.157 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -79.83 -54.11 6.14 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.409 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.631 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -50.61 -32.06 17.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.144 -179.489 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.665 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 72.7 m -85.42 -34.66 21.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.568 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.591 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.0 t -51.11 -36.43 40.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.223 0.535 . . . . 0.0 109.602 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 75.6 mt -81.41 -59.0 2.79 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.245 179.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 68.8 m -101.59 -57.03 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.836 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.665 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 124.39 163.14 11.61 Favored Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.624 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.768 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -111.86 167.98 9.94 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.453 0.644 . . . . 0.0 111.432 179.802 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.699 ' O ' HD12 ' A' ' 125' ' ' LEU . 42.3 p -103.44 155.28 18.62 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-N 114.755 -1.111 . . . . 0.0 109.496 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.886 ' HG2' HG22 ' B' ' 45' ' ' VAL . 31.2 mt-30 -58.84 -5.75 0.66 Allowed 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.626 HE21 HD12 ' A' ' 126' ' ' LEU . 1.4 mp0 -88.42 -51.78 5.54 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 176.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.599 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t70 -55.01 -56.2 22.36 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.752 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.1 mt -56.01 -32.05 63.63 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.714 179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.626 HD12 HE21 ' A' ' 123' ' ' GLN . 5.8 mt -62.7 -30.59 71.51 Favored 'General case' 0 CA--C 1.524 -0.053 0 CA-C-O 121.028 0.442 . . . . 0.0 110.191 178.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.562 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -96.42 -5.25 40.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.559 -179.725 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.752 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.9 mt -92.65 -21.29 20.11 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.974 -0.291 . . . . 0.0 110.992 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 30.3 p -66.94 153.29 94.65 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.764 179.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -78.18 6.07 4.96 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.16 2.573 . . . . 0.0 112.476 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.846 -179.999 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo . . . . . 0 N--CA 1.485 1.029 0 N-CA-C 111.145 -0.367 . . . . 0.0 111.145 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.44 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 14.9 p 61.92 133.21 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.602 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 84.5 Cg_endo -97.09 -157.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.972 0 C-N-CA 123.167 2.578 . . . . 0.0 111.76 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -80.92 76.35 7.86 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.587 0.708 . . . . 0.0 110.228 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 8.4 ttt -80.74 115.43 20.24 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.182 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -80.28 151.82 29.36 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.492 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 10.9 pt-20 -163.75 136.51 5.23 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.592 0.71 . . . . 0.0 110.936 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 82.0 mttt -55.54 117.5 3.64 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.322 -1.308 . . . . 0.0 112.478 -178.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.809 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 21.4 mt -116.93 100.91 8.08 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.183 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.591 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 83.2 m -95.79 76.78 3.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.27 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.34 -81.98 0.2 Allowed Glycine 0 C--O 1.229 -0.193 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.842 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.563 ' O ' ' HG3' ' B' ' 40' ' ' ARG . 11.3 t-160 -60.27 -53.41 57.99 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 117.285 0.542 . . . . 0.0 110.725 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.597 ' HA ' ' HE ' ' B' ' 40' ' ' ARG . 13.1 m-70 -52.58 -45.13 66.33 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.809 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 24.2 t80 -56.03 -29.36 60.3 Favored 'General case' 0 N--CA 1.432 -1.354 0 CA-C-N 113.104 -1.862 . . . . 0.0 109.85 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.704 ' O ' HG23 ' B' ' 43' ' ' VAL . 0.9 OUTLIER -73.09 -57.63 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.038 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 176.387 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.597 ' HE ' ' HA ' ' B' ' 37' ' ' HIS . 23.9 mtm180 -44.92 -66.7 0.36 Allowed 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.159 179.118 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.892 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.08 -46.5 61.8 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.669 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -47.82 -39.11 17.43 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.265 0.555 . . . . 0.0 109.792 -179.673 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.718 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.7 OUTLIER -73.22 -65.03 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.95 178.238 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -34.94 -41.04 0.13 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.165 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.892 HG23 ' O ' ' B' ' 41' ' ' ALA . 66.5 t -74.46 -61.86 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 113.34 -1.755 . . . . 0.0 112.89 -179.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 8.9 t -119.54 -54.58 2.16 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.368 -176.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.515 ' C ' ' HE1' ' B' ' 51' ' ' TRP . . . 142.45 -115.53 0.96 Allowed Glycine 0 C--N 1.318 -0.453 0 CA-C-N 114.61 -1.177 . . . . 0.0 111.719 -178.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.521 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 153.92 -142.57 9.25 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.627 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.592 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 97.7 Cg_endo -79.18 42.59 1.32 Allowed 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.888 2.392 . . . . 0.0 112.55 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 68.51 -25.55 0.14 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.718 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 11.4 m95 57.67 9.13 0.77 Allowed 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 178.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . 0.497 ' O ' ' N ' ' B' ' 54' ' ' GLU . 64.6 m 53.6 -100.07 0.1 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.224 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 28.1 p 50.03 -79.8 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.628 0.58 . . . . 0.0 112.171 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . 0.497 ' N ' ' O ' ' B' ' 52' ' ' SER . 20.0 mm-40 -81.66 28.83 0.39 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.14 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.356 -0.83 . . . . 0.0 111.028 179.89 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.7 0.286 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.26 150.39 23.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.941 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -106.34 -165.58 1.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.133 0.492 . . . . 0.0 111.475 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.477 HG23 ' N ' ' A' ' 110' ' ' ASN . 15.3 t -76.4 -145.54 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.488 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.477 ' N ' HG23 ' A' ' 109' ' ' THR . 2.5 m-20 -79.34 119.22 76.29 Favored Pre-proline 0 C--N 1.331 -0.21 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.624 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 60.9 Cg_endo -69.69 -10.31 28.29 Favored 'Trans proline' 0 C--N 1.343 0.239 0 C-N-CA 122.329 2.019 . . . . 0.0 113.021 -179.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -93.47 -43.8 8.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.098 0.475 . . . . 0.0 111.336 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -77.1 -48.41 17.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.926 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.624 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -55.22 -30.58 60.27 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.095 -179.248 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.673 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 70.7 m -84.01 -29.0 27.3 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.19 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.601 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 51.4 t -54.94 -42.73 72.67 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.407 ' O ' ' HE2' ' B' ' 32' ' ' LYS . 12.0 mt -81.51 -46.48 14.43 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.926 179.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.0 m -102.92 -74.44 0.63 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.1 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.673 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 135.1 156.93 7.84 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.589 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.946 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -108.46 168.07 9.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.522 0.677 . . . . 0.0 111.765 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.754 ' O ' HD12 ' A' ' 125' ' ' LEU . 26.9 p -107.69 158.67 17.08 Favored 'General case' 0 CA--C 1.505 -0.771 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.696 178.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.848 ' HG2' HG22 ' B' ' 45' ' ' VAL . 30.4 mt-30 -62.57 -2.38 1.07 Allowed 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.717 ' O ' HG23 ' A' ' 127' ' ' THR . 27.1 mt-30 -90.65 -57.07 2.95 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 176.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.537 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.5 OUTLIER -54.44 -53.39 54.82 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.304 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.754 HD12 ' O ' ' A' ' 121' ' ' THR . 1.2 mt -56.05 -36.37 67.96 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.789 178.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' B' ' 46' ' ' CYS . 5.6 mt -62.27 -31.06 71.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 120.974 0.416 . . . . 0.0 109.942 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.717 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -90.19 -7.72 52.91 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.47 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.604 HD12 ' HA ' ' A' ' 125' ' ' LEU . 31.4 mt -94.99 -13.56 25.16 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.148 0.499 . . . . 0.0 109.984 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.418 ' SG ' ' CD ' ' A' ' 130' ' ' PRO . 1.6 t -51.64 157.25 1.93 Allowed Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.917 178.096 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.418 ' CD ' ' SG ' ' A' ' 129' ' ' CYS . 2.4 Cg_endo -84.45 9.84 3.97 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 123.407 2.738 . . . . 0.0 112.087 -179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.815 179.928 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . 0.472 ' O ' HG23 ' B' ' 26' ' ' THR . 1.9 Cg_endo . . . . . 0 N--CA 1.484 0.93 0 N-CA-C 111.034 -0.41 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.472 HG23 ' O ' ' B' ' 25' ' ' PRO . 0.8 OUTLIER -162.61 148.53 10.21 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.923 -179.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -89.57 85.95 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.834 2.356 . . . . 0.0 112.352 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 34.98 52.19 0.59 Allowed 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 121.611 0.72 . . . . 0.0 111.961 -179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.5 tpt -76.73 110.37 11.26 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.202 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -75.43 125.89 29.9 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.397 -1.274 . . . . 0.0 111.661 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 9.0 pt-20 -137.42 144.65 42.48 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.515 0.674 . . . . 0.0 110.846 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 4.6 mtpm? -60.4 106.58 0.55 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.394 -1.276 . . . . 0.0 112.421 -177.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.946 HD12 ' SG ' ' A' ' 120' ' ' CYS . 60.1 mt -106.14 98.19 7.91 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.18 -1.373 . . . . 0.0 111.945 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.601 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.6 m -93.22 71.05 4.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.214 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.7 -75.18 0.57 Allowed Glycine 0 N--CA 1.453 -0.182 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.443 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.549 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 7.8 t-160 -64.27 -51.35 63.98 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 117.133 0.466 . . . . 0.0 110.569 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.574 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 13.2 m-70 -56.13 -39.18 71.85 Favored 'General case' 0 CA--C 1.498 -1.056 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.783 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 38.4 t80 -63.46 -26.4 68.71 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 113.238 -1.801 . . . . 0.0 109.216 179.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.697 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.6 t -74.57 -67.28 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.286 -0.87 . . . . 0.0 108.79 176.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.582 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.7 OUTLIER -45.37 -58.47 3.3 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.207 0.317 . . . . 0.0 110.51 178.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.929 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -50.1 -51.86 39.5 Favored 'General case' 0 C--O 1.214 -0.81 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -44.58 -44.67 8.98 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.313 0.578 . . . . 0.0 110.465 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.695 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -69.34 -62.65 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.898 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -35.56 -39.83 0.15 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.849 -1.068 . . . . 0.0 109.684 177.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.929 HG23 ' O ' ' B' ' 41' ' ' ALA . 57.3 t -74.13 -58.19 5.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 113.257 -1.792 . . . . 0.0 111.904 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.608 ' HB2' HD23 ' A' ' 126' ' ' LEU . 39.5 t -129.27 -64.91 0.88 Allowed 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.853 -177.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.526 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 161.25 -118.82 0.85 Allowed Glycine 0 N--CA 1.45 -0.43 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.433 -178.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.55 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 157.62 -141.7 7.99 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.301 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.567 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 92.5 Cg_endo -79.01 43.4 1.47 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.84 2.36 . . . . 0.0 112.433 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 32.9 mmt180 68.47 -26.69 0.14 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.232 0.613 . . . . 0.0 112.555 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.697 ' CH2' HG13 ' B' ' 39' ' ' VAL . 9.5 m95 58.29 9.22 0.96 Allowed 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 6.3 m -126.3 -165.46 1.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.337 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 72.1 p 48.95 87.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.152 0.501 . . . . 0.0 111.156 -179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 41.55 85.17 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.622 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.116 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.788 0.328 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.97 120.76 15.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.154 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.402 ' O ' ' C ' ' A' ' 109' ' ' THR . . . -105.72 125.09 50.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.213 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.467 HG23 ' N ' ' A' ' 110' ' ' ASN . 9.1 t 34.15 -129.6 0.07 Allowed 'General case' 0 CA--C 1.53 0.209 0 O-C-N 123.622 0.576 . . . . 0.0 111.073 179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.467 ' N ' HG23 ' A' ' 109' ' ' THR . 15.8 m120 -88.61 104.08 6.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.548 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 72.8 Cg_endo -69.89 -13.0 33.75 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.299 1.999 . . . . 0.0 112.781 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.38 -44.94 8.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.539 -179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.9 mmt180 -77.38 -45.29 26.41 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.954 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.548 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -58.13 -28.49 64.72 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.956 -179.16 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.737 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 98.7 m -84.68 -24.09 29.12 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.9 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.646 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.6 t -60.57 -45.18 94.88 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.6 mt -80.96 -40.84 23.78 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.498 178.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 22.8 t -101.68 -78.45 0.53 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.391 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.737 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 129.2 147.35 6.32 Favored Glycine 0 C--O 1.228 -0.261 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.732 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 1.023 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -109.85 142.4 41.2 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.081 0.467 . . . . 0.0 110.86 179.203 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.762 HG23 ' HG2' ' B' ' 30' ' ' ARG . 10.7 p -72.01 -91.12 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 122.333 1.063 . . . . 0.0 111.453 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.894 ' HG2' HG22 ' B' ' 45' ' ' VAL . 9.7 mt-30 -156.28 -30.64 0.09 Allowed 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 112.986 -1.915 . . . . 0.0 108.546 179.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.691 ' O ' HG23 ' A' ' 127' ' ' THR . 49.3 mt-30 -63.66 -49.08 74.61 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.55 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 31.5 t70 -57.05 -56.46 21.44 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.643 HD21 HD13 ' B' ' 33' ' ' LEU . 1.1 mt -58.3 -25.33 61.73 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.76 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.44 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 11.2 mt -71.77 -30.87 66.04 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.874 0.369 . . . . 0.0 110.338 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' 123' ' ' GLN . 1.4 p -92.1 -7.28 49.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.232 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 24.1 mt -95.48 -22.76 17.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.763 0.316 . . . . 0.0 110.919 -179.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . . . . . . . . . 17.4 p -69.45 164.81 46.22 Favored Pre-proline 0 C--N 1.332 -0.185 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.511 178.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_exo -72.76 159.98 47.26 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.709 2.272 . . . . 0.0 111.865 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.145 -0.931 . . . . 0.0 111.049 -179.781 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo . . . . . 0 N--CA 1.485 0.994 0 N-CA-C 110.991 -0.427 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 56.1 p -72.9 135.46 80.51 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.269 -179.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 72.3 Cg_endo -95.59 -159.05 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.001 2.467 . . . . 0.0 111.527 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.682 ' HB2' HG21 ' A' ' 121' ' ' THR . 4.9 pt-20 -81.48 74.22 8.49 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.793 0.806 . . . . 0.0 110.047 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.2 tpt -85.1 112.0 20.27 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.248 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.762 ' HG2' HG23 ' A' ' 121' ' ' THR . 13.7 mtt180 -76.4 110.16 10.7 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.718 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.61 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 10.1 tp10 -115.23 142.45 46.66 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.303 0.573 . . . . 0.0 111.713 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 76.7 mttt -63.27 102.23 0.38 Allowed 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.647 -1.16 . . . . 0.0 111.912 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 1.023 HD12 ' SG ' ' A' ' 120' ' ' CYS . 60.4 mt -101.16 102.37 13.28 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.911 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.646 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 1.3 t -97.84 76.0 2.42 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.412 0.625 . . . . 0.0 111.355 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.435 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 70.35 -73.91 0.56 Allowed Glycine 0 C--N 1.319 -0.416 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.678 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.486 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.2 t-160 -67.73 -52.86 32.56 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 117.142 0.471 . . . . 0.0 111.002 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.526 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.7 m170 -54.58 -36.22 64.15 Favored 'General case' 0 CA--C 1.495 -1.161 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 176.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.785 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 41.7 t80 -66.67 -29.62 69.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 112.96 -1.927 . . . . 0.0 109.517 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.675 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.9 t -71.88 -68.25 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.305 -0.861 . . . . 0.0 108.694 177.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.573 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.2 mpt_? -45.53 -56.7 4.81 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-O 119.523 -0.275 . . . . 0.0 110.316 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.87 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -51.31 -51.61 52.72 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.783 -0.767 . . . . 0.0 109.078 179.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.65 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.5 OUTLIER -43.14 -46.53 5.91 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.413 0.625 . . . . 0.0 110.303 179.852 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.686 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -68.76 -64.71 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.179 179.101 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -34.08 -41.64 0.11 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.249 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.894 HG22 ' HG2' ' A' ' 122' ' ' GLN . 71.5 t -74.26 -60.22 2.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 113.304 -1.771 . . . . 0.0 112.682 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 9.6 t -123.69 -59.58 1.52 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.522 -176.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.518 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 152.29 -113.12 0.56 Allowed Glycine 0 N--CA 1.452 -0.266 0 CA-C-N 114.775 -1.102 . . . . 0.0 112.359 -178.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.492 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 150.33 -144.14 11.54 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.429 -0.891 . . . . 0.0 112.606 -179.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.581 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 86.8 Cg_endo -81.34 45.76 2.07 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.882 2.388 . . . . 0.0 112.604 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 68.23 -27.55 0.14 Allowed 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.686 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 17.1 m95 58.43 10.29 1.3 Allowed 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . 0.47 ' O ' ' N ' ' B' ' 54' ' ' GLU . 4.0 m -109.98 -173.5 2.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.966 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 69.4 p 53.01 -79.03 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.86 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . 0.47 ' N ' ' O ' ' B' ' 52' ' ' SER . 26.9 tt0 -159.08 134.91 8.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.6 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.084 179.921 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.774 0.321 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -144.74 -16.63 0.53 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.046 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.85 -168.18 1.41 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.103 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.613 HG23 ' HB2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -76.46 -84.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.305 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.499 ' H ' HG23 ' A' ' 109' ' ' THR . 2.2 m120 -156.28 97.49 2.21 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.275 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' A' ' 112' ' ' ALA . 19.3 Cg_endo -56.4 90.26 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.089 1.859 . . . . 0.0 111.536 -179.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 111' ' ' PRO . . . 159.46 -64.24 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 114.387 -1.279 . . . . 0.0 107.867 -179.185 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 2.3 mpp_? -77.29 -20.96 54.29 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.613 ' HB2' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -65.4 -41.68 93.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 113.57 -1.65 . . . . 0.0 109.981 179.028 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.6 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 2.2 m -92.72 -22.65 19.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.09 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.603 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 43.1 t -65.02 -36.26 83.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.913 0.387 . . . . 0.0 110.516 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.68 -46.34 15.73 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.856 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 31.7 m -117.37 -44.64 2.76 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.501 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 119.84 163.72 12.34 Favored Glycine 0 C--N 1.334 0.418 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.557 -178.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.617 ' HB2' HD12 ' B' ' 33' ' ' LEU . 81.9 m -134.08 139.04 45.7 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.354 0.597 . . . . 0.0 112.321 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.822 HG23 ' HG3' ' B' ' 30' ' ' ARG . 58.8 p -75.41 154.01 37.37 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.695 179.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.759 ' HG2' HG22 ' B' ' 45' ' ' VAL . 13.4 mt-30 -53.38 -19.9 3.95 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.704 HE21 HD12 ' A' ' 126' ' ' LEU . 8.3 mm-40 -68.98 -52.77 25.48 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 177.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.539 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.2 OUTLIER -55.24 -54.01 48.79 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.392 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.763 HD12 ' O ' ' A' ' 121' ' ' THR . 1.4 mp -59.55 -29.87 68.22 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.451 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.704 HD12 HE21 ' A' ' 123' ' ' GLN . 7.5 mt -64.04 -29.97 71.07 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 178.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -101.36 -0.28 35.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.408 -179.882 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.667 HD12 ' HA ' ' A' ' 125' ' ' LEU . 52.0 mt -92.01 -23.58 19.48 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.667 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' B' ' 46' ' ' CYS . 18.4 p -71.19 156.88 91.26 Favored Pre-proline 0 C--O 1.232 0.147 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.69 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 2.3 Cg_endo -82.66 15.06 2.13 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.136 2.557 . . . . 0.0 112.736 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.904 179.944 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo . . . . . 0 N--CA 1.482 0.823 0 N-CA-C 111.195 -0.348 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 74.1 p -73.28 133.28 81.1 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.991 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -95.41 67.43 0.22 Allowed 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.945 2.43 . . . . 0.0 112.129 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . 0.551 ' HB2' ' HB ' ' A' ' 121' ' ' THR . 8.8 pt-20 36.53 73.24 0.09 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.839 0.828 . . . . 0.0 111.333 -178.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 43.0 ttm -82.35 13.69 3.42 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.442 -1.254 . . . . 0.0 111.086 -179.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.822 ' HG3' HG23 ' A' ' 121' ' ' THR . 0.1 OUTLIER 34.14 96.37 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.184 -0.916 . . . . 0.0 113.157 178.734 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.459 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 11.6 pt-20 -119.56 156.74 29.76 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.104 0.478 . . . . 0.0 110.252 178.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -61.31 108.15 0.88 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.179 -0.919 . . . . 0.0 113.168 -177.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.753 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 7.3 mt -103.87 96.8 6.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.896 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.603 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 5.0 t -96.27 90.56 5.51 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.36 0.6 . . . . 0.0 111.254 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.428 ' O ' ' N ' ' B' ' 39' ' ' VAL . . . 61.71 -78.71 0.02 OUTLIER Glycine 0 C--N 1.321 -0.255 0 CA-C-N 114.849 -1.069 . . . . 0.0 112.973 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.479 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 3.5 t-160 -66.06 -52.62 47.29 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 117.449 0.624 . . . . 0.0 111.215 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.475 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 4.4 m-70 -55.82 -35.64 66.57 Favored 'General case' 0 CA--C 1.501 -0.906 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 177.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.753 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 28.2 t80 -68.86 -26.73 65.29 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-N 112.962 -1.926 . . . . 0.0 109.433 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.638 HG13 ' CH2' ' B' ' 51' ' ' TRP . 1.4 t -74.17 -67.12 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 CA-C-N 115.179 -0.918 . . . . 0.0 108.852 177.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.585 ' N ' HG12 ' B' ' 39' ' ' VAL . 1.6 mpt_? -44.74 -61.6 1.52 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 119.264 -0.398 . . . . 0.0 110.627 179.011 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.791 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -49.43 -45.76 46.86 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 119.861 -0.735 . . . . 0.0 109.548 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.644 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.3 OUTLIER -49.78 -41.16 43.65 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.065 0.46 . . . . 0.0 110.346 179.507 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.716 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 0.2 OUTLIER -75.79 -61.67 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.292 179.432 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . 0.421 ' C ' ' O ' ' B' ' 43' ' ' VAL . 5.2 mtt180 -33.19 -41.48 0.07 Allowed 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 122.547 1.165 . . . . 0.0 108.853 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.791 HG23 ' O ' ' B' ' 41' ' ' ALA . 82.5 t -74.99 -68.57 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 CA-C-N 112.871 -1.968 . . . . 0.0 112.621 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 129' ' ' CYS . 8.5 t -127.77 -60.44 1.16 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.866 -175.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.716 ' HA2' ' HA ' ' B' ' 43' ' ' VAL . . . 110.86 95.72 2.32 Favored Glycine 0 N--CA 1.453 -0.172 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.956 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.69 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . -50.88 -97.99 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 121.376 -0.44 . . . . 0.0 113.125 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.558 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 19.2 Cg_endo -89.83 175.16 3.14 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 124.573 3.515 . . . . 0.0 111.094 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -81.9 112.8 19.34 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 122.899 1.333 . . . . 0.0 109.54 178.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.679 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 9.9 m95 -72.82 -77.78 0.1 Allowed 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 112.184 -2.28 . . . . 0.0 113.294 -177.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 22.2 m -152.42 132.43 13.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.116 0.484 . . . . 0.0 111.93 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.9 p -155.69 77.07 0.96 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.277 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -82.54 -2.26 53.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.015 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.24 -0.886 . . . . 0.0 111.313 179.993 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.736 0.303 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.69 4.96 52.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.124 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -131.75 -160.81 1.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.082 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.602 HG23 ' H ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER -75.07 -85.82 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.247 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.602 ' H ' HG23 ' A' ' 109' ' ' THR . 15.3 m120 -153.21 86.7 4.03 Favored Pre-proline 0 C--N 1.32 -0.696 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.541 ' HG3' HD22 ' A' ' 128' ' ' LEU . 28.0 Cg_endo -57.58 -4.46 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.869 2.379 . . . . 0.0 113.795 -177.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.404 ' HA ' ' CD2' ' B' ' 38' ' ' PHE . . . -88.2 -49.62 6.88 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.486 0.66 . . . . 0.0 109.722 178.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 26.7 mtm180 -78.77 -26.24 44.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.182 178.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.485 ' C ' ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -70.54 -55.25 9.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.966 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.581 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 10.0 m -68.89 -24.4 64.32 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.242 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.626 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 38.0 t -61.3 -52.89 62.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.813 0.339 . . . . 0.0 111.15 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 12.0 mt -79.2 -34.72 42.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.056 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 57.0 m -106.4 -59.88 1.73 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.567 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 120.72 162.14 11.65 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.469 ' HB2' HD12 ' B' ' 33' ' ' LEU . 73.2 m -143.02 147.09 34.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.799 0.799 . . . . 0.0 112.882 -179.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.829 ' O ' HD12 ' A' ' 125' ' ' LEU . 29.5 p -87.64 169.78 11.84 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.005 179.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.904 ' HG2' HG22 ' B' ' 45' ' ' VAL . 28.5 mt-30 -66.63 3.46 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.368 178.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.722 ' O ' HG23 ' A' ' 127' ' ' THR . 25.3 mt-30 -94.31 -54.83 3.4 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.57 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 0.1 OUTLIER -56.33 -53.4 57.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.574 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.829 HD12 ' O ' ' A' ' 121' ' ' THR . 1.0 OUTLIER -56.75 -33.09 66.23 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.32 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.495 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 5.7 mt -66.78 -35.52 80.28 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.067 0.46 . . . . 0.0 110.033 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.722 HG23 ' O ' ' A' ' 123' ' ' GLN . 5.3 p -82.97 -5.89 59.26 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.463 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.666 HD12 ' HA ' ' A' ' 125' ' ' LEU . 50.3 mt -92.84 -70.8 0.68 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.823 -179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.68 ' H ' HD21 ' B' ' 42' ' ' LEU . 0.0 OUTLIER 47.19 -172.5 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.883 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.606 ' HD3' ' HA2' ' B' ' 48' ' ' GLY . 1.3 Cg_endo -80.11 141.5 14.74 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.755 1.637 . . . . 0.0 112.35 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.187 179.69 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.484 0.953 0 N-CA-C 111.179 -0.354 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.401 ' HA ' ' HD3' ' B' ' 27' ' ' PRO . 3.9 t -166.18 143.44 4.4 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.115 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 85.0 Cg_endo -97.31 -157.72 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 123.331 2.687 . . . . 0.0 111.917 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -81.24 75.63 8.2 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.599 0.714 . . . . 0.0 110.241 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.05 119.77 23.95 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.168 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.559 ' NE ' HG23 ' A' ' 121' ' ' THR . 17.3 mmt180 -77.54 120.2 22.18 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.245 -0.888 . . . . 0.0 111.118 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.649 ' HG3' HD21 ' B' ' 33' ' ' LEU . 10.3 pt-20 -133.1 143.86 49.58 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.321 0.582 . . . . 0.0 110.466 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 78.0 mttt -62.93 113.27 2.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.862 -1.063 . . . . 0.0 113.22 -177.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.778 ' HB3' ' HA ' ' B' ' 38' ' ' PHE . 6.7 mt -110.19 99.7 8.72 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.842 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.626 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.9 OUTLIER -99.03 95.32 7.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.298 0.57 . . . . 0.0 111.354 179.539 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 59.95 -82.42 0.01 OUTLIER Glycine 0 C--N 1.321 -0.254 0 CA-C-N 114.873 -1.058 . . . . 0.0 113.18 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.491 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 4.0 t-160 -66.21 -51.64 55.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 117.273 0.536 . . . . 0.0 111.501 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.427 ' CB ' ' HA ' ' B' ' 33' ' ' LEU . 5.1 m-70 -54.0 -39.7 66.3 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 176.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.778 ' HA ' ' HB3' ' B' ' 33' ' ' LEU . 22.4 t80 -64.39 -28.91 70.01 Favored 'General case' 0 N--CA 1.427 -1.576 0 CA-C-N 112.692 -2.049 . . . . 0.0 109.597 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.681 HG13 ' CH2' ' B' ' 51' ' ' TRP . 2.2 t -72.58 -69.74 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.546 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.8 OUTLIER -41.06 -57.57 2.0 Allowed 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 123.382 0.426 . . . . 0.0 111.258 179.421 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.871 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -55.44 -50.24 70.33 Favored 'General case' 0 C--O 1.21 -0.987 0 C-N-CA 119.591 -0.844 . . . . 0.0 109.408 179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.706 ' HB2' ' O ' ' B' ' 38' ' ' PHE . 0.4 OUTLIER -46.5 -35.91 6.18 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.271 0.558 . . . . 0.0 110.749 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.748 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.5 OUTLIER -77.51 -61.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.849 178.998 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 3.6 mmm180 -37.29 -40.37 0.34 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 122.622 1.201 . . . . 0.0 109.493 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.904 HG22 ' HG2' ' A' ' 122' ' ' GLN . 47.4 t -79.31 -71.22 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 112.607 -2.088 . . . . 0.0 114.108 -178.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 5.6 t -101.44 -26.01 13.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.789 -176.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.427 ' O ' ' C ' ' B' ' 48' ' ' GLY . . . 84.02 13.49 74.47 Favored Glycine 0 C--N 1.318 -0.449 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -178.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.606 ' HA2' ' HD3' ' A' ' 130' ' ' PRO . . . 27.24 -133.97 0.03 OUTLIER Glycine 0 C--N 1.34 0.775 0 O-C-N 124.413 0.713 . . . . 0.0 113.094 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.573 ' HD2' ' CZ2' ' B' ' 51' ' ' TRP . 60.5 Cg_endo -70.6 -144.13 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.512 2.141 . . . . 0.0 110.345 178.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.531 ' HE ' ' HB2' ' B' ' 52' ' ' SER . 6.8 ptm180 -89.68 -28.92 19.12 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.748 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 45.5 m95 63.2 10.04 4.35 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . 0.531 ' HB2' ' HE ' ' B' ' 50' ' ' ARG . 51.1 m -89.89 -10.45 45.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.009 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 55.2 p -81.38 90.1 6.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.131 0.491 . . . . 0.0 111.027 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 46.78 86.38 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.195 -0.912 . . . . 0.0 111.37 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.156 -0.926 . . . . 0.0 111.056 -179.837 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.824 0.345 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -164.69 35.69 0.07 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.157 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -105.4 28.75 7.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.179 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 6.1 t 40.74 58.54 2.4 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.271 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.47 ' HB2' ' HB2' ' A' ' 113' ' ' ARG . 2.5 m-20 47.61 94.36 0.05 OUTLIER Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.44 -178.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.412 ' HA ' ' HD2' ' A' ' 114' ' ' TYR . 27.1 Cg_endo -59.16 -4.62 2.32 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.092 1.861 . . . . 0.0 112.237 -179.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -98.96 -41.14 7.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.211 0.529 . . . . 0.0 110.581 179.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.47 ' HB2' ' HB2' ' A' ' 110' ' ' ASN . 27.4 mmt180 -77.59 -36.62 51.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.833 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.463 ' CZ ' ' SG ' ' A' ' 120' ' ' CYS . 0.0 OUTLIER -65.54 -36.92 85.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.365 -179.494 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.568 ' HB2' ' HB2' ' B' ' 33' ' ' LEU . 13.5 m -83.15 -22.85 33.18 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.21 178.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.597 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 40.6 t -61.35 -54.04 48.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.315 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 55.5 mt -79.3 -32.51 43.53 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 70.7 m -105.5 -61.61 1.47 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.476 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 121.13 154.12 9.19 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 -178.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.608 ' HB3' ' HB3' ' A' ' 124' ' ' ASP . 92.1 m -133.78 139.58 46.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.779 ' O ' HD12 ' A' ' 125' ' ' LEU . 43.2 p -73.99 160.36 31.43 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.868 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.874 ' HG2' HG22 ' B' ' 45' ' ' VAL . 18.5 mt-30 -57.61 -16.98 12.01 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.644 ' O ' HG23 ' A' ' 127' ' ' THR . 6.3 mt-30 -70.55 -52.11 23.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.608 ' HB3' ' HB3' ' A' ' 120' ' ' CYS . 7.9 t70 -54.0 -54.36 40.11 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.808 ' HB2' HG21 ' B' ' 45' ' ' VAL . 1.1 mt -58.82 -31.14 68.2 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.776 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 122' ' ' GLN . 8.6 mt -64.79 -27.6 69.0 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 109.895 178.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.644 HG23 ' O ' ' A' ' 123' ' ' GLN . 0.7 OUTLIER -91.45 -16.46 27.27 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.291 -179.821 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 124' ' ' ASP . 17.1 mt -95.91 -4.61 43.2 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.339 0.59 . . . . 0.0 109.865 -179.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.561 ' N ' ' CD ' ' A' ' 130' ' ' PRO . 15.8 t -58.7 -44.89 99.53 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 115.072 -0.967 . . . . 0.0 112.65 179.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 129' ' ' CYS . 72.5 Cg_endo -87.0 12.07 3.08 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.726 2.951 . . . . 0.0 112.771 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.188 -0.91 . . . . 0.0 110.836 179.864 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . 0.489 ' O ' HG23 ' B' ' 26' ' ' THR . 1.6 Cg_endo . . . . . 0 N--CA 1.482 0.848 0 N-CA-C 111.181 -0.353 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.489 HG23 ' O ' ' B' ' 25' ' ' PRO . 1.4 p -161.27 143.46 9.07 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.802 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' B' ' 26' ' ' THR . 88.1 Cg_endo -97.97 58.68 0.08 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 123.286 2.657 . . . . 0.0 111.897 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 37.68 69.61 0.23 Allowed 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.049 -178.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 1.8 tpt -75.83 116.07 16.16 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.427 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.49 ' HE ' HG23 ' A' ' 121' ' ' THR . 8.7 mtt180 -75.29 165.74 24.71 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.965 -178.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.531 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 6.4 tp10 -169.73 140.73 2.18 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.36 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.8 103.63 1.16 Allowed 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.301 -179.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.783 ' HB3' ' CA ' ' B' ' 38' ' ' PHE . 26.9 mt -98.67 97.1 8.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.713 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.597 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 67.2 m -95.48 78.13 3.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.297 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 68.05 -80.49 0.19 Allowed Glycine 0 C--O 1.228 -0.23 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.541 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.485 ' O ' ' HB ' ' B' ' 39' ' ' VAL . 9.2 t-160 -60.3 -55.89 28.22 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 117.083 0.441 . . . . 0.0 110.696 179.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.54 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 14.5 m-70 -51.83 -43.81 63.3 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.783 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.9 t80 -60.08 -27.99 67.44 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-N 112.993 -1.912 . . . . 0.0 110.067 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.711 HG13 ' CH2' ' B' ' 51' ' ' TRP . 0.9 OUTLIER -73.11 -62.46 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.307 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.566 ' N ' HG12 ' B' ' 39' ' ' VAL . 0.6 OUTLIER -48.27 -64.14 0.88 Allowed 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 119.23 -0.414 . . . . 0.0 110.704 178.902 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.836 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -47.16 -44.06 21.56 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.105 -0.638 . . . . 0.0 109.782 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.638 ' N ' HD22 ' A' ' 125' ' ' LEU . 0.5 OUTLIER -50.49 -45.22 56.27 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-O 121.451 0.643 . . . . 0.0 110.137 179.622 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.72 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.2 OUTLIER -72.85 -60.62 2.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.129 179.055 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 4.6 mtt180 -34.66 -41.6 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 122.264 1.03 . . . . 0.0 109.123 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.874 HG22 ' HG2' ' A' ' 122' ' ' GLN . 70.6 t -72.44 -61.1 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 113.399 -1.728 . . . . 0.0 111.84 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 129' ' ' CYS . 34.8 t -138.8 -61.02 0.58 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.413 -1.267 . . . . 0.0 111.679 -176.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.582 ' CA ' ' HA ' ' B' ' 43' ' ' VAL . . . 167.51 -117.41 0.73 Allowed Glycine 0 N--CA 1.445 -0.704 0 CA-C-N 114.736 -1.12 . . . . 0.0 112.485 -178.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.615 ' N ' ' HE1' ' B' ' 51' ' ' TRP . . . 162.4 -134.19 3.38 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.198 -179.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.507 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 91.0 Cg_endo -78.41 41.56 1.07 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.944 2.429 . . . . 0.0 112.331 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.412 ' C ' ' CD1' ' B' ' 51' ' ' TRP . 2.6 mmp_? 69.39 -30.13 0.19 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.252 0.621 . . . . 0.0 112.504 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.72 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 9.3 m95 64.11 -71.19 0.07 Allowed 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.097 0.475 . . . . 0.0 111.967 179.042 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 73.9 m -145.68 -104.9 0.1 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.533 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 58.2 p 40.63 73.8 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.469 0.652 . . . . 0.0 111.737 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -84.08 24.69 0.9 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.131 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.033 -179.985 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.862 0.363 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -151.09 -20.36 0.21 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.296 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -110.62 105.96 15.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.381 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.436 HG23 ' H ' ' A' ' 110' ' ' ASN . 0.0 OUTLIER 33.6 -94.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.211 179.787 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.436 ' H ' HG23 ' A' ' 109' ' ' THR . 15.8 m120 -152.51 93.15 3.34 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.614 ' HA ' ' CD2' ' A' ' 114' ' ' TYR . 55.8 Cg_endo -65.81 -8.25 19.09 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.44 2.094 . . . . 0.0 113.075 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -91.27 -41.3 11.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.244 0.545 . . . . 0.0 110.606 179.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -79.77 -49.89 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.792 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.614 ' CD2' ' HA ' ' A' ' 111' ' ' PRO . 0.1 OUTLIER -53.84 -31.63 50.08 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.965 -179.11 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.699 ' HA ' ' H ' ' A' ' 119' ' ' GLY . 65.0 m -81.53 -34.35 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.446 -0.501 . . . . 0.0 111.828 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.632 ' HB2' ' HA ' ' B' ' 34' ' ' CYS . 48.0 t -56.18 -34.64 66.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 98.6 mt -81.6 -55.66 4.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.281 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 16.0 p -104.7 -53.32 2.71 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.994 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.699 ' H ' ' HA ' ' A' ' 115' ' ' CYS . . . 118.62 162.87 12.31 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.913 -0.661 . . . . 0.0 111.926 -179.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . 0.84 ' SG ' HD12 ' B' ' 33' ' ' LEU . 0.0 OUTLIER -117.4 157.28 26.47 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.545 0.688 . . . . 0.0 111.878 179.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.636 ' O ' HD12 ' A' ' 125' ' ' LEU . 58.3 p -93.69 159.64 15.12 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.526 178.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.876 ' HG2' HG22 ' B' ' 45' ' ' VAL . 26.3 mt-30 -65.37 6.1 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.73 ' O ' HG23 ' A' ' 127' ' ' THR . 56.8 mt-30 -98.26 -53.65 3.29 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 175.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.544 ' O ' ' HG ' ' A' ' 128' ' ' LEU . 3.4 m-20 -56.73 -53.98 51.54 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.727 ' HA ' HD12 ' A' ' 128' ' ' LEU . 1.2 mt -56.2 -32.54 64.47 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.901 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.498 ' HG ' ' CG1' ' B' ' 45' ' ' VAL . 6.3 mt -67.29 -37.59 83.66 Favored 'General case' 0 C--N 1.341 0.201 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . 0.73 HG23 ' O ' ' A' ' 123' ' ' GLN . 7.0 p -79.17 -5.9 55.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.118 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.727 HD12 ' HA ' ' A' ' 125' ' ' LEU . 71.0 mt -91.24 -74.79 0.49 Allowed 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.565 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' CYS . . . . . 0.728 ' H ' HD21 ' B' ' 42' ' ' LEU . 0.1 OUTLIER 46.28 -174.67 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 179.973 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.488 ' HD3' ' SG ' ' A' ' 129' ' ' CYS . 13.6 Cg_exo -71.08 -9.12 25.0 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.811 1.674 . . . . 0.0 112.106 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.965 -179.8 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . 0.5 ' O ' HG23 ' B' ' 26' ' ' THR . 9.8 Cg_endo . . . . . 0 N--CA 1.485 1.017 0 N-CA-C 111.028 -0.412 . . . . 0.0 111.028 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.5 HG23 ' O ' ' B' ' 25' ' ' PRO . 2.2 p -161.07 126.81 2.3 Favored Pre-proline 0 CA--C 1.531 0.216 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.012 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -99.44 -156.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.564 2.843 . . . . 0.0 111.534 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -80.98 77.56 7.87 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 121.512 0.672 . . . . 0.0 109.833 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 6.6 ttp -78.66 114.64 17.76 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 114.735 -1.121 . . . . 0.0 110.197 -179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 8.3 mtt180 -78.37 172.29 13.83 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.3 -1.318 . . . . 0.0 112.042 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' B' ' 33' ' ' LEU . 8.9 tp10 -170.94 131.37 0.82 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.604 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 70.2 mttt -63.75 110.4 2.04 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.739 -178.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.84 HD12 ' SG ' ' A' ' 120' ' ' CYS . 25.6 mt -107.82 108.36 19.52 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.403 -1.271 . . . . 0.0 113.012 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' CYS . . . . . 0.632 ' HA ' ' HB2' ' A' ' 116' ' ' CYS . 0.5 OUTLIER -102.1 77.84 1.72 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.396 0.617 . . . . 0.0 111.06 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.494 ' O ' ' HB3' ' B' ' 38' ' ' PHE . . . 71.17 -79.9 0.5 Allowed Glycine 0 C--N 1.318 -0.47 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.994 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.517 ' O ' ' HD2' ' B' ' 40' ' ' ARG . 6.1 t-160 -64.37 -51.95 60.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 117.43 0.615 . . . . 0.0 110.981 179.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' HIS . . . . . 0.418 ' HB2' ' HA ' ' B' ' 33' ' ' LEU . 10.8 m170 -54.58 -37.06 65.07 Favored 'General case' 0 CA--C 1.496 -1.123 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 176.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.807 ' CA ' ' HB3' ' B' ' 33' ' ' LEU . 28.1 t80 -64.9 -27.99 69.23 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 113.095 -1.866 . . . . 0.0 109.736 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.667 ' O ' HG23 ' B' ' 43' ' ' VAL . 1.7 t -73.63 -64.71 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.517 ' HD2' ' O ' ' B' ' 36' ' ' HIS . 1.1 mpt_? -44.26 -59.88 2.17 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 123.37 0.419 . . . . 0.0 111.456 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.924 ' O ' HG23 ' B' ' 45' ' ' VAL . . . -54.09 -46.18 71.99 Favored 'General case' 0 C--O 1.21 -0.974 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.45 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.728 HD21 ' H ' ' A' ' 129' ' ' CYS . 0.4 OUTLIER -47.87 -37.9 15.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.479 0.657 . . . . 0.0 110.076 -179.888 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.676 HG22 ' CZ2' ' B' ' 51' ' ' TRP . 0.6 OUTLIER -75.32 -60.45 2.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.071 178.902 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' ARG . . . . . 0.485 ' HG3' ' HA ' ' B' ' 41' ' ' ALA . 4.6 mtt180 -39.1 -37.54 0.39 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.333 1.063 . . . . 0.0 109.323 177.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.924 HG23 ' O ' ' B' ' 41' ' ' ALA . 59.2 t -79.31 -70.78 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 113.223 -1.808 . . . . 0.0 113.894 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' CYS . . . . . . . . . . . . . 10.0 t -99.92 -29.74 12.4 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.773 -176.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' B' ' 43' ' ' VAL . . . 91.82 11.79 59.97 Favored Glycine 0 C--N 1.318 -0.437 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.603 -178.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.521 ' CA ' ' HE1' ' B' ' 51' ' ' TRP . . . 39.1 -141.89 0.49 Allowed Glycine 0 CA--C 1.52 0.359 0 O-C-N 123.717 0.304 . . . . 0.0 113.73 179.294 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.616 ' HD2' ' CE2' ' B' ' 51' ' ' TRP . 59.9 Cg_endo -71.3 -68.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.071 2.514 . . . . 0.0 114.025 -179.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' ARG . . . . . 0.429 ' H ' ' HG2' ' B' ' 49' ' ' PRO . 82.1 mtm180 -156.29 -41.11 0.08 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.579 -178.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.676 ' CZ2' HG22 ' B' ' 43' ' ' VAL . 14.5 m95 60.8 8.42 1.81 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.993 179.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . 0.463 ' O ' ' N ' ' B' ' 54' ' ' GLU . 70.0 m -64.99 -67.13 0.46 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.698 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 67.9 p 53.88 -77.89 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.934 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' GLU . . . . . 0.463 ' N ' ' O ' ' B' ' 52' ' ' SER . 40.2 mt-10 -81.08 9.7 6.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.746 0.308 . . . . 0.0 110.888 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.236 179.968 . . . . . . . . 0 0 . 1 stop_ save_