data_1ti5_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 1ti5 _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 ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.485 0.66 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.848 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -162.52 159.02 24.35 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.389 -0.82 . . . . 0.0 111.223 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.648 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.7 m -130.27 138.45 50.5 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.773 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.5 OUTLIER -111.17 146.56 36.65 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 122.139 0.971 . . . . 0.0 111.536 -178.778 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.709 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -123.77 179.73 2.62 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.662 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.59 ' N ' HG13 ' A' ' 5' ' ' ILE . 1.1 mppt? -101.45 108.42 20.0 Favored 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.572 -0.705 . . . . 0.0 110.44 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 10.8 mmtm -94.77 55.69 1.92 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.127 -0.983 . . . . 0.0 109.603 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -22.3 66.7 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.202 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.94 -6.44 52.24 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.735 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.94 -24.73 16.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.274 -1.133 . . . . 0.0 110.401 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.92 141.81 6.9 Favored Glycine 0 N--CA 1.487 2.077 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -41.09 164.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.489 -1.006 . . . . 0.0 110.372 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.6 t -111.07 151.93 27.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 0.0 110.685 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.536 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.27 -31.32 8.68 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.496 -0.753 . . . . 0.0 110.088 179.766 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.536 HG12 ' HG ' ' A' ' 14' ' ' LEU . 3.3 mm -117.19 -145.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.475 -0.765 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.424 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 15.5 m-20 -119.38 -26.43 5.83 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.525 -0.734 . . . . 0.0 109.338 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.5 m -98.74 -32.33 11.44 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.503 -0.748 . . . . 0.0 109.559 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.454 ' C ' ' O ' ' A' ' 17' ' ' THR . 94.1 m -40.62 -45.82 2.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.36 -0.838 . . . . 0.0 109.236 179.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.608 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 9.1 t -68.53 -48.01 65.44 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.773 0.797 . . . . 0.0 109.14 178.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.545 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -50.64 -36.81 37.23 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 110.49 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -54.58 -62.72 1.47 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.133 -0.979 . . . . 0.0 109.549 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.735 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.5 m -53.31 -39.66 64.19 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.446 -0.784 . . . . 0.0 109.717 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.553 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.1 m -57.59 -62.1 2.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 110.509 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.619 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 24.3 ttpt -49.55 -61.31 2.18 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.33 -0.856 . . . . 0.0 109.469 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -47.47 -29.6 2.83 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.2 0.524 . . . . 0.0 110.499 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -79.25 -20.88 47.08 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.176 -0.952 . . . . 0.0 108.756 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.16 37.79 0.68 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.619 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 11.2 m-85 -124.31 168.0 13.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.367 -1.078 . . . . 0.0 110.457 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.603 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -76.7 -28.79 17.65 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-O 122.21 1.005 . . . . 0.0 108.31 178.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.577 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 176.99 -159.1 25.32 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.632 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.18 -179.75 36.1 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.428 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 O-C-N 121.331 -1.1 . . . . 0.0 110.721 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 5.8 t . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 121.065 0.46 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.709 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-85 -105.83 167.2 9.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 109.548 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.773 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.3 m -143.59 119.51 10.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.706 -1.246 . . . . 0.0 110.891 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -85.04 140.81 30.73 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.732 0.777 . . . . 0.0 110.633 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.848 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -127.33 166.64 23.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.14 0.495 . . . . 0.0 109.84 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.58 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.27 89.95 3.15 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 177.92 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.779 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.742 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.401 0.62 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.881 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -157.59 158.36 35.42 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.909 0.862 . . . . 0.0 111.329 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.648 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.8 m -131.06 139.17 49.87 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.75 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.6 OUTLIER -109.75 145.95 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 122.038 0.923 . . . . 0.0 111.409 -178.829 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.715 HG13 ' N ' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -122.27 179.02 2.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.938 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.715 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -98.02 108.44 21.14 Favored 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.462 -179.938 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -98.27 55.45 1.13 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.119 -0.988 . . . . 0.0 109.661 179.556 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.477 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -67.15 -26.75 66.81 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.319 0.58 . . . . 0.0 110.103 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.477 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -61.78 -12.67 36.06 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.693 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 36.8 m0 -91.98 -17.97 24.36 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.266 -1.138 . . . . 0.0 110.303 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.469 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 108.0 140.04 9.19 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -40.93 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.591 -0.946 . . . . 0.0 110.122 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.8 t -110.22 151.53 27.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.188 -0.945 . . . . 0.0 110.77 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.576 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.71 -31.25 8.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.571 -0.706 . . . . 0.0 109.965 179.666 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.576 HG12 ' HG ' ' A' ' 14' ' ' LEU . 4.0 mm -109.93 -143.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.568 -0.708 . . . . 0.0 110.127 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.43 ' OD1' ' C ' ' A' ' 15' ' ' ILE . 25.8 m-20 -125.69 -20.8 4.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.369 -0.832 . . . . 0.0 109.876 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.486 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.3 m -105.13 -30.18 9.9 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.34 -0.85 . . . . 0.0 109.752 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.486 ' C ' ' O ' ' A' ' 17' ' ' THR . 1.0 OUTLIER -39.74 -53.99 2.14 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.288 -0.882 . . . . 0.0 109.205 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.593 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.2 t -58.74 -51.53 69.57 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.358 -0.839 . . . . 0.0 109.072 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.577 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.39 -41.21 19.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.804 -0.56 . . . . 0.0 110.804 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -54.29 -61.71 2.13 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.103 -0.998 . . . . 0.0 109.766 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.693 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -53.74 -37.53 63.45 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.398 -0.814 . . . . 0.0 110.03 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.57 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 63.6 m -58.43 -61.88 2.26 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.341 -0.85 . . . . 0.0 110.635 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.656 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 6.0 mtpt -50.69 -60.68 2.8 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.305 -0.872 . . . . 0.0 109.6 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -47.16 -29.69 2.45 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.182 0.515 . . . . 0.0 110.472 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 0.3 OUTLIER -79.6 -23.49 42.66 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.256 -0.903 . . . . 0.0 108.815 179.42 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.25 41.15 0.37 Allowed Glycine 0 N--CA 1.484 1.846 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.656 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 27.7 m-85 -129.44 169.2 15.23 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.276 -1.132 . . . . 0.0 110.592 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.593 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -78.99 -28.3 13.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 122.19 0.995 . . . . 0.0 108.371 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.577 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.91 -158.57 23.69 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.663 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.48 -162.22 12.25 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.561 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 O-C-N 121.305 -1.115 . . . . 0.0 111.01 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.922 0.391 . . . . 0.0 110.558 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.697 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.5 m-30 -99.45 163.16 12.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.001 -1.062 . . . . 0.0 109.649 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.75 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.7 m -140.09 119.09 12.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.816 -1.177 . . . . 0.0 110.763 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -83.68 139.91 32.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.537 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.881 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.46 166.79 22.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-O 121.207 0.527 . . . . 0.0 109.801 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.588 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.34 90.03 3.19 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 177.795 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.723 -176.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.42 0.629 . . . . 0.0 110.375 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.896 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.95 158.09 41.57 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.377 -0.827 . . . . 0.0 111.085 178.882 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.639 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.6 m -129.18 138.8 51.95 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.739 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 18.5 mtm -109.85 146.19 35.5 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.113 0.959 . . . . 0.0 111.484 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.679 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -124.28 179.53 2.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.708 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.573 ' N ' HG13 ' A' ' 5' ' ' ILE . 8.0 mttt -101.37 109.23 21.03 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 121.634 -0.666 . . . . 0.0 110.336 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.688 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -93.83 55.24 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.105 -0.997 . . . . 0.0 109.511 179.503 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.54 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.9 OUTLIER -65.49 -28.99 69.59 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.323 0.582 . . . . 0.0 110.173 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.54 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -63.14 -11.07 37.13 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 37.2 m0 -93.72 -19.38 21.13 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.257 -1.143 . . . . 0.0 110.247 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 105.69 141.35 10.54 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.462 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -38.61 154.89 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.575 -0.956 . . . . 0.0 110.087 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 31.7 t -94.27 150.06 20.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.144 -0.972 . . . . 0.0 110.58 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.544 HD12 ' CG1' ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.46 -31.2 8.65 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.463 -0.773 . . . . 0.0 110.034 179.729 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.544 ' CG1' HD12 ' A' ' 14' ' ' LEU . 2.4 mm -115.15 -155.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.494 -0.754 . . . . 0.0 110.321 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.407 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.35 -26.1 11.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.688 179.666 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.492 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.3 OUTLIER -104.0 -28.95 11.23 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.457 -0.777 . . . . 0.0 109.638 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.492 ' C ' ' O ' ' A' ' 17' ' ' THR . 3.0 m -39.02 -55.4 1.58 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.376 -0.828 . . . . 0.0 109.358 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.588 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -58.19 -52.28 66.21 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.342 -0.849 . . . . 0.0 108.977 178.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.46 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.87 -42.25 47.32 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.704 -0.622 . . . . 0.0 110.441 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -51.42 -59.05 4.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 0.0 109.709 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.688 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -57.35 -37.42 72.56 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.369 -0.832 . . . . 0.0 109.966 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.538 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.9 m -59.83 -60.06 4.44 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.259 -0.901 . . . . 0.0 110.568 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' O ' ' N ' ' A' ' 27' ' ' GLY . 16.9 mtpt -51.46 -60.76 2.78 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.637 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -43.52 -29.81 0.51 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.147 0.498 . . . . 0.0 110.686 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.577 ' HG2' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -79.79 -28.44 40.28 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.217 -0.927 . . . . 0.0 108.703 179.39 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 129.75 37.57 0.36 Allowed Glycine 0 N--CA 1.484 1.865 0 N-CA-C 108.678 -1.769 . . . . 0.0 108.678 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.577 ' CE2' ' HG2' ' A' ' 26' ' ' ARG . 20.5 m-85 -121.48 168.11 12.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.334 -1.098 . . . . 0.0 110.697 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.6 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -78.83 -28.12 13.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-O 122.102 0.953 . . . . 0.0 108.564 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.568 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.66 -160.3 26.8 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.578 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.31 172.53 37.56 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.613 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.305 -1.341 0 O-C-N 121.081 -1.246 . . . . 0.0 111.053 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.688 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.3 t . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 121.111 0.481 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.679 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 8.6 m-85 -109.99 169.27 8.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.12 -0.987 . . . . 0.0 109.133 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.739 ' O ' ' HA ' ' A' ' 4' ' ' MET . 86.2 m -143.99 118.98 9.99 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.701 -1.249 . . . . 0.0 110.725 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.639 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -85.83 139.04 31.62 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.486 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.896 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.24 23.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.577 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.23 89.82 3.12 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.431 ' O ' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.766 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.789 -176.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.498 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.487 0.66 . . . . 0.0 110.462 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.88 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.65 159.02 43.21 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.396 -0.815 . . . . 0.0 110.882 178.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.668 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.5 m -129.41 138.5 51.52 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.752 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.2 OUTLIER -110.15 142.66 41.35 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-O 122.051 0.929 . . . . 0.0 111.248 -178.888 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.724 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -120.9 178.14 2.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.584 ' N ' HG13 ' A' ' 5' ' ' ILE . 8.7 mttp -98.96 108.78 21.55 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.794 -0.566 . . . . 0.0 110.075 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.702 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.7 OUTLIER -98.1 55.68 1.17 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.118 -0.989 . . . . 0.0 109.873 179.764 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -21.3 64.72 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.279 0.561 . . . . 0.0 110.071 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.54 -6.84 51.43 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.744 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.281 -1.129 . . . . 0.0 110.215 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 108.77 140.68 9.18 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.456 ' C ' ' CD ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -41.29 155.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.458 -1.025 . . . . 0.0 110.173 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.5 t -100.22 153.28 19.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.173 -0.955 . . . . 0.0 110.762 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.525 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -107.35 -31.41 8.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.562 -0.711 . . . . 0.0 109.985 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.525 HG12 ' HG ' ' A' ' 14' ' ' LEU . 2.9 mm -117.37 -150.8 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.487 -0.758 . . . . 0.0 110.274 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.405 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 4.5 m-20 -113.44 -26.13 8.47 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.443 -0.785 . . . . 0.0 109.427 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.469 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -99.21 -29.76 12.65 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.5 -0.75 . . . . 0.0 109.487 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.473 ' OG1' ' CG1' ' A' ' 15' ' ' ILE . 90.0 m -40.38 -49.72 2.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.38 -0.825 . . . . 0.0 109.276 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -64.31 -50.53 67.45 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.345 -0.847 . . . . 0.0 109.073 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.55 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.81 -39.64 18.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.734 -0.604 . . . . 0.0 110.662 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 10.2 m170 -53.03 -61.34 2.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.212 -0.93 . . . . 0.0 109.677 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.744 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.8 m -55.84 -38.75 70.47 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.459 -0.776 . . . . 0.0 109.87 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.533 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.3 m -58.8 -61.86 2.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.331 -0.856 . . . . 0.0 110.313 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.5 OUTLIER -50.66 -61.17 2.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.386 -0.821 . . . . 0.0 109.628 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -51.16 -27.6 9.04 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.15 0.5 . . . . 0.0 110.502 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -78.52 -22.43 47.36 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.2 -0.938 . . . . 0.0 108.677 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.36 38.54 0.51 Allowed Glycine 0 N--CA 1.484 1.871 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.628 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.2 m-85 -128.56 170.9 12.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.258 -1.142 . . . . 0.0 110.641 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.588 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -77.87 -28.32 15.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 CA-C-O 122.199 1.0 . . . . 0.0 108.433 179.197 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.568 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.0 -157.74 22.97 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.676 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.54 -166.2 18.87 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.57 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.408 0 O-C-N 121.292 -1.122 . . . . 0.0 110.686 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.702 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.5 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.03 0.443 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.724 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.9 m-85 -108.5 166.65 10.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.009 -1.057 . . . . 0.0 109.515 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.752 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.16 120.15 12.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.774 -1.204 . . . . 0.0 110.713 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.668 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -85.68 137.61 32.71 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.462 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.88 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.97 166.47 22.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.177 0.513 . . . . 0.0 109.774 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.564 ' ND2' HD13 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.19 90.58 3.12 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.929 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.498 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.756 -176.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.503 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.413 0.625 . . . . 0.0 110.418 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.91 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -150.04 158.08 43.8 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.073 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.667 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.5 m -128.59 138.71 52.35 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.761 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.04 143.06 40.6 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 122.064 0.935 . . . . 0.0 111.569 -178.784 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.713 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -120.54 -179.85 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.795 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.597 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -103.06 110.59 22.57 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 121.744 -0.598 . . . . 0.0 110.418 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.703 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.3 OUTLIER -100.69 54.81 0.87 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.044 -1.035 . . . . 0.0 109.692 179.428 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -23.6 67.41 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.285 0.564 . . . . 0.0 110.058 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.96 -7.71 44.79 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.699 ' CE3' ' OG ' ' A' ' 22' ' ' SER . 38.8 m0 -95.47 -19.52 19.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.252 -1.146 . . . . 0.0 110.295 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 106.93 140.86 9.87 Favored Glycine 0 N--CA 1.488 2.125 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.507 ' CD ' ' N ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -39.28 160.65 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.994 . . . . 0.0 110.282 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.1 t -103.05 152.82 20.92 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.242 -0.911 . . . . 0.0 110.597 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.544 HD13 ' CD1' ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.61 -30.89 9.21 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 110.064 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.544 ' CD1' HD13 ' A' ' 14' ' ' LEU . 3.5 mm -116.77 -148.41 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.525 -0.734 . . . . 0.0 110.283 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.437 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 8.9 m-20 -114.58 -25.81 8.17 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.465 -0.772 . . . . 0.0 109.396 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.49 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -101.92 -29.85 11.58 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.565 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.49 ' C ' ' O ' ' A' ' 17' ' ' THR . 4.4 m -39.42 -53.4 2.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.385 -0.822 . . . . 0.0 109.294 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.575 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 5.5 t -60.24 -46.14 90.83 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.376 -0.827 . . . . 0.0 109.038 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.538 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.53 -39.52 64.73 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.689 -0.632 . . . . 0.0 110.362 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.56 -59.21 4.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.174 -0.954 . . . . 0.0 109.617 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.699 ' OG ' ' CE3' ' A' ' 10' ' ' TRP . 9.0 t -58.44 -36.66 73.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.432 -0.792 . . . . 0.0 110.033 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.538 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 70.0 m -61.35 -60.86 3.07 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.316 -0.865 . . . . 0.0 110.443 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.593 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -52.56 -59.61 4.24 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.411 -0.806 . . . . 0.0 109.808 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -44.17 -30.06 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.228 0.537 . . . . 0.0 110.504 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.452 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 3.1 ttm-85 -79.72 -28.85 40.51 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.163 -0.961 . . . . 0.0 108.798 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 132.07 39.21 0.24 Allowed Glycine 0 N--CA 1.483 1.825 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.593 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.1 m-85 -125.23 170.09 11.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.375 -1.074 . . . . 0.0 110.692 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.6 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -79.56 -28.47 13.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.117 0.96 . . . . 0.0 108.502 179.124 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.564 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.27 -158.59 24.22 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.596 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.77 172.48 37.11 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.609 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.382 0 O-C-N 121.181 -1.188 . . . . 0.0 110.879 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.703 ' O ' ' N ' ' A' ' 7' ' ' LYS . 3.1 t . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 121.009 0.433 . . . . 0.0 110.76 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.713 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.3 m-85 -107.62 168.87 8.95 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.067 -1.02 . . . . 0.0 108.714 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.761 ' O ' ' HA ' ' A' ' 4' ' ' MET . 78.1 m -141.0 119.69 12.48 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.703 -1.248 . . . . 0.0 111.053 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.667 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -85.34 136.6 33.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.745 0.783 . . . . 0.0 110.224 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.91 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.0 165.62 23.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.572 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -75.84 90.65 2.93 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 106.606 -1.627 . . . . 0.0 106.606 177.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.503 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.752 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.791 -176.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.463 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.403 0.621 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.85 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -158.03 159.66 36.61 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.339 -0.85 . . . . 0.0 111.308 179.129 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.681 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.4 m -129.07 139.28 52.08 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.745 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -110.13 146.36 35.61 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.012 0.911 . . . . 0.0 111.609 -178.621 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.66 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -121.99 179.59 2.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.591 ' HG2' ' CZ ' ' A' ' 41' ' ' TYR . 6.3 mttp -100.63 108.97 21.0 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.74 -0.6 . . . . 0.0 110.597 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.697 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -95.37 56.0 1.8 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.092 -1.005 . . . . 0.0 109.592 179.316 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.478 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -69.65 -18.66 63.6 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.4 179.989 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.478 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -77.93 -0.79 76.83 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.726 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 42.1 m0 -100.84 -15.47 17.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -1.169 . . . . 0.0 110.251 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.89 141.44 9.8 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.491 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -41.3 165.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.461 -1.023 . . . . 0.0 110.19 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.3 t -107.84 153.75 22.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.135 -0.978 . . . . 0.0 110.89 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.551 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -108.33 -30.74 8.17 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 121.556 0.693 . . . . 0.0 110.006 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.551 HG12 ' HG ' ' A' ' 14' ' ' LEU . 3.6 mm -119.52 -147.92 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.556 -0.715 . . . . 0.0 110.351 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.42 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 21.1 m-20 -116.12 -25.6 7.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.43 -0.794 . . . . 0.0 109.372 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.64 -30.0 12.72 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.472 -0.767 . . . . 0.0 109.536 179.328 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.473 ' C ' ' O ' ' A' ' 17' ' ' THR . 44.9 m -41.05 -54.59 2.77 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.339 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.621 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.0 t -60.23 -49.99 75.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.306 -0.871 . . . . 0.0 109.076 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.528 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.65 -41.55 43.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.739 -0.601 . . . . 0.0 110.715 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -51.51 -59.83 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.714 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.726 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.5 m -56.35 -37.48 70.07 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.405 -0.809 . . . . 0.0 109.817 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.535 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.0 m -59.32 -61.99 2.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.431 -0.793 . . . . 0.0 110.526 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 7.8 mtpt -50.25 -60.22 3.19 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.418 -0.801 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.05 -30.0 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.312 0.577 . . . . 0.0 110.139 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.4 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 36.8 tpt85 -78.58 -21.38 48.72 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.333 -0.855 . . . . 0.0 108.822 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 122.03 40.81 0.5 Allowed Glycine 0 N--CA 1.484 1.837 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.628 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.8 m-85 -128.81 169.53 14.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -1.083 . . . . 0.0 110.654 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.589 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.9 OUTLIER -78.58 -28.82 14.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.553 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.43 -157.33 21.1 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.657 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.23 -165.86 17.93 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.569 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 O-C-N 121.185 -1.185 . . . . 0.0 110.953 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.697 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.9 t . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 121.073 0.463 . . . . 0.0 110.749 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.66 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 4.6 m-85 -110.17 167.1 10.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.1 -1.0 . . . . 0.0 109.352 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.745 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.9 m -141.6 119.34 11.78 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.648 -1.282 . . . . 0.0 110.834 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.681 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -86.21 139.96 30.57 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.793 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.85 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.53 166.89 22.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.181 0.515 . . . . 0.0 109.707 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.582 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 90.35 3.19 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 177.954 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.786 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.415 0.626 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.875 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -160.49 158.6 29.58 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.832 0.825 . . . . 0.0 111.222 178.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.668 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.6 m -129.32 138.38 51.54 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.75 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.9 OUTLIER -110.17 141.26 43.33 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-O 122.091 0.948 . . . . 0.0 111.272 -178.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.735 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -119.87 179.44 2.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.798 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.609 ' HG3' ' CZ ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -102.48 105.39 15.93 Favored 'General case' 0 C--N 1.294 -1.81 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.706 ' N ' ' O ' ' A' ' 40' ' ' CYS . 43.3 mmtt -92.05 56.47 2.87 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.968 -1.082 . . . . 0.0 109.561 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.488 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.7 OUTLIER -64.93 -24.88 67.66 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.169 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.488 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -67.24 -7.9 47.53 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.738 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.2 m0 -94.78 -17.27 22.3 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -1.165 . . . . 0.0 110.335 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.65 140.59 8.2 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.409 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.4 OUTLIER -44.84 157.35 0.07 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.431 -1.041 . . . . 0.0 109.836 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 18.0 t -105.59 152.35 23.2 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.115 -0.99 . . . . 0.0 111.087 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.527 ' CG ' HD12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -111.92 -30.59 7.22 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.553 0.692 . . . . 0.0 109.934 179.471 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.561 ' CD1' ' N ' ' A' ' 15' ' ' ILE . 1.5 mm -107.2 -148.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.502 -0.749 . . . . 0.0 110.466 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -122.55 -25.24 4.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.383 -0.823 . . . . 0.0 109.677 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.482 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -103.07 -29.89 11.08 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.4 -0.812 . . . . 0.0 109.512 179.505 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.482 ' C ' ' O ' ' A' ' 17' ' ' THR . 18.4 m -40.59 -47.4 2.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.302 -0.874 . . . . 0.0 109.092 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.629 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.2 t -66.9 -50.33 62.78 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-O 121.793 0.806 . . . . 0.0 109.112 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.51 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -48.17 -39.83 22.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.704 -0.623 . . . . 0.0 110.519 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.407 ' C ' ' CD2' ' A' ' 21' ' ' HIS . 3.7 t-160 -54.37 -61.74 2.11 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.194 -0.942 . . . . 0.0 109.595 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.738 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.3 m -52.81 -39.16 62.14 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.371 -0.831 . . . . 0.0 109.74 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.521 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 57.7 m -57.6 -62.05 2.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.662 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLY . 9.5 mtpt -49.39 -61.02 2.33 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.383 -0.823 . . . . 0.0 109.278 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m-20 -45.79 -31.41 2.04 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.189 0.519 . . . . 0.0 110.347 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -20.65 48.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.265 -0.897 . . . . 0.0 108.814 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 120.21 40.85 0.57 Allowed Glycine 0 N--CA 1.484 1.856 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.575 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 34.8 m-85 -126.59 168.47 14.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.37 -1.077 . . . . 0.0 110.696 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.6 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -78.56 -28.44 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 CA-C-O 122.141 0.972 . . . . 0.0 108.553 179.196 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.588 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.99 -159.2 24.72 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.639 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.65 -162.52 12.61 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.578 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 O-C-N 121.235 -1.156 . . . . 0.0 110.893 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.706 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 121.122 0.486 . . . . 0.0 110.871 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.735 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 11.4 m-85 -106.86 169.94 8.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.116 -0.99 . . . . 0.0 109.395 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.75 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.5 m -146.6 119.02 8.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.645 -1.285 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.668 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -84.9 138.5 32.48 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.652 0.739 . . . . 0.0 110.364 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.875 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.73 166.68 22.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-O 121.136 0.493 . . . . 0.0 109.796 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.566 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.21 89.72 3.11 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.815 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.44 ' OXT' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.753 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.796 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.43 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.3 ttp180 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.365 0.602 . . . . 0.0 110.381 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.913 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -151.85 157.8 42.38 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.232 178.969 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.637 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.6 m -129.82 139.1 51.3 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.798 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.99 144.5 41.22 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-O 122.097 0.951 . . . . 0.0 111.589 -178.727 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.668 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -123.32 179.36 2.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.704 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.603 ' HA ' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -97.63 112.03 24.07 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.556 -0.715 . . . . 0.0 110.456 -179.918 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.665 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -94.3 54.69 1.9 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.075 -1.016 . . . . 0.0 109.699 179.606 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.437 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.1 OUTLIER -70.28 -26.73 63.94 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.36 0.6 . . . . 0.0 110.1 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.437 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -65.19 -9.84 44.13 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.731 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.06 -16.72 22.46 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.338 -1.095 . . . . 0.0 110.337 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.504 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 110.73 141.81 8.92 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.504 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -34.23 151.45 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.646 -0.914 . . . . 0.0 110.304 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 15' ' ' ILE . 17.9 t -95.69 152.19 18.68 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.302 -0.874 . . . . 0.0 110.706 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.513 ' C ' ' CD1' ' A' ' 15' ' ' ILE . 0.2 OUTLIER -115.05 -31.7 5.96 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.521 -0.737 . . . . 0.0 110.731 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.522 ' CG1' ' OG1' ' A' ' 18' ' ' THR . 3.4 mm -128.22 169.18 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.217 -0.927 . . . . 0.0 111.065 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -75.22 -21.21 58.81 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.444 -0.785 . . . . 0.0 110.453 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.471 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.1 OUTLIER -106.62 -39.97 5.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.197 -0.939 . . . . 0.0 109.643 179.781 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.522 ' OG1' ' CG1' ' A' ' 15' ' ' ILE . 99.0 m -41.24 -39.05 1.25 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.273 -0.892 . . . . 0.0 108.654 179.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.572 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 6.2 t -71.54 -49.35 41.56 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.519 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.95 -35.94 62.3 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.749 -0.594 . . . . 0.0 110.307 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -53.6 -61.84 2.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.253 -0.905 . . . . 0.0 109.328 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.731 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 14.5 m -54.94 -41.94 71.67 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.41 -0.806 . . . . 0.0 109.505 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.539 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.4 m -56.29 -61.87 2.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.319 -0.863 . . . . 0.0 110.413 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 15.8 mtmt -50.1 -61.12 2.34 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.418 -0.801 . . . . 0.0 109.629 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -47.35 -29.52 2.61 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.211 0.529 . . . . 0.0 110.504 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -22.05 45.15 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.216 -0.928 . . . . 0.0 108.846 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 123.32 37.88 0.58 Allowed Glycine 0 N--CA 1.484 1.886 0 N-CA-C 108.802 -1.719 . . . . 0.0 108.802 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.592 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 6.8 m-85 -123.74 169.69 11.26 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -1.076 . . . . 0.0 110.463 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.612 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.9 OUTLIER -80.45 -28.08 11.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 CA-C-O 122.202 1.001 . . . . 0.0 108.343 178.88 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.561 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.93 -159.46 24.42 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.593 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.41 172.36 36.8 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.612 ' C ' ' OD1' ' A' ' 32' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 O-C-N 121.016 -1.285 . . . . 0.0 111.458 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.665 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.2 t . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 121.141 0.496 . . . . 0.0 111.053 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.668 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-30 -110.72 168.75 9.24 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 108.762 178.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.798 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -142.0 118.54 10.96 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.717 -1.239 . . . . 0.0 110.776 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.637 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -85.24 137.89 32.7 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.218 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.913 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.88 166.63 21.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.139 0.495 . . . . 0.0 109.799 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.565 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.26 89.76 3.14 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.774 -176.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.42 ' C ' ' OG1' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.458 0.647 . . . . 0.0 110.442 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.851 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -167.53 159.28 12.05 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.792 0.806 . . . . 0.0 111.231 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.653 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.7 m -130.42 139.09 50.61 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.751 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 46.4 mtm -108.01 143.75 36.27 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.12 0.962 . . . . 0.0 111.548 -178.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.703 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -118.49 179.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.645 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.58 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.15 107.92 19.46 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.656 -0.652 . . . . 0.0 110.365 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.69 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -95.11 55.7 1.83 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.128 -0.982 . . . . 0.0 109.523 179.408 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.37 -17.19 64.18 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.256 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.24 -4.3 78.65 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.743 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 40.4 m0 -97.55 -24.71 15.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.389 -1.065 . . . . 0.0 110.337 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.34 142.0 7.08 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -40.59 163.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.503 -0.998 . . . . 0.0 110.281 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 t -105.43 151.87 23.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.189 -0.945 . . . . 0.0 110.788 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.537 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -107.35 -31.57 8.13 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.468 -0.77 . . . . 0.0 109.972 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.537 HG12 ' HG ' ' A' ' 14' ' ' LEU . 4.2 mm -120.87 -147.23 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.517 -0.739 . . . . 0.0 110.26 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.44 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 0.9 OUTLIER -114.38 -26.66 7.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.437 -0.79 . . . . 0.0 109.241 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.449 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.68 -30.97 12.15 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.487 -0.758 . . . . 0.0 109.577 179.534 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.501 HG21 ' CD2' ' A' ' 14' ' ' LEU . 25.8 m -40.83 -47.96 3.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.381 -0.824 . . . . 0.0 109.29 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.598 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.3 t -67.33 -48.59 67.1 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.376 -0.827 . . . . 0.0 109.117 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.538 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.53 -38.51 54.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.692 -0.63 . . . . 0.0 110.534 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.09 -59.98 3.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.165 -0.959 . . . . 0.0 109.622 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.743 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.8 m -57.58 -38.87 75.58 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.382 -0.824 . . . . 0.0 109.706 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.541 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.5 m -60.13 -61.6 2.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.96 -61.0 2.49 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.607 179.9 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -51.04 -27.94 9.11 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-O 121.175 0.512 . . . . 0.0 110.601 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 22' ' ' SER . 13.4 tpt180 -78.04 -23.39 48.16 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.782 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.71 35.68 0.59 Allowed Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.631 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.4 m-85 -125.15 170.5 11.16 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -1.115 . . . . 0.0 110.752 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.619 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.9 OUTLIER -76.01 -28.66 19.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-O 122.234 1.016 . . . . 0.0 108.298 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.576 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 175.99 -157.62 23.77 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.664 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.61 173.76 37.19 Favored Glycine 0 N--CA 1.488 2.111 0 C-N-CA 119.696 -1.24 . . . . 0.0 110.006 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.406 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--N 1.304 -1.395 0 O-C-N 121.389 -1.065 . . . . 0.0 110.667 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.69 ' O ' ' N ' ' A' ' 7' ' ' LYS . 7.9 t . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 121.14 0.495 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.703 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.0 m-85 -107.09 166.38 10.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.159 -0.963 . . . . 0.0 109.322 178.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.751 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.01 119.37 12.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.671 -1.268 . . . . 0.0 111.012 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.653 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -83.41 138.48 33.47 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.796 0.808 . . . . 0.0 110.539 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.851 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.18 166.14 22.93 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.573 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.13 89.87 3.07 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.123 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.401 ' OXT' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.861 -176.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.435 0.636 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.89 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -154.89 158.64 39.63 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.348 -0.845 . . . . 0.0 111.106 178.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.665 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.7 m -130.33 138.06 50.24 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.656 0.741 . . . . 0.0 109.028 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.677 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -107.55 143.51 35.86 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 122.003 0.906 . . . . 0.0 111.209 -179.159 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.687 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -122.56 178.05 3.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.561 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -97.43 109.47 22.22 Favored 'General case' 0 C--N 1.296 -1.738 0 O-C-N 121.803 -0.561 . . . . 0.0 110.436 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -97.51 55.73 1.26 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.0 109.571 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.49 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -68.54 -20.28 64.54 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.434 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.49 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -75.47 0.96 59.01 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.7 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 41.2 m0 -102.8 -17.78 15.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -1.146 . . . . 0.0 110.336 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.14 140.77 8.41 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.547 ' O ' ' CD ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -43.7 162.51 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.422 -1.046 . . . . 0.0 110.447 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.5 t -108.6 148.0 30.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.275 -0.891 . . . . 0.0 110.396 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.546 ' CD1' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.88 -32.57 8.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.4 -0.813 . . . . 0.0 110.392 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.546 HD13 ' CD1' ' A' ' 14' ' ' LEU . 4.0 mm -109.18 -146.57 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.425 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 0.8 OUTLIER -117.59 -25.0 7.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 179.497 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.451 ' O ' ' C ' ' A' ' 18' ' ' THR . 2.4 m -103.28 -24.2 13.54 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.539 -0.726 . . . . 0.0 109.441 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.451 ' C ' ' O ' ' A' ' 17' ' ' THR . 24.8 m -40.41 -52.26 2.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 0.0 109.389 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 24.1 t -64.02 -50.49 68.27 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.289 -0.882 . . . . 0.0 109.136 178.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.496 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -46.21 -40.3 11.12 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.729 -0.607 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -53.11 -60.64 3.03 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.198 -0.939 . . . . 0.0 109.828 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.7 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -56.98 -37.19 71.25 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.416 -0.803 . . . . 0.0 110.088 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.563 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 57.8 m -59.47 -62.07 2.15 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 110.319 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 25.4 tttt -50.84 -60.63 2.87 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 109.626 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -46.66 -30.54 2.39 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.215 0.531 . . . . 0.0 110.551 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -79.11 -23.1 44.31 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.221 -0.925 . . . . 0.0 108.705 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.16 37.77 0.55 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.987 -1.645 . . . . 0.0 108.987 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.59 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.0 m-85 -122.61 168.62 11.94 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.348 -1.089 . . . . 0.0 110.601 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.609 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -78.51 -28.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-O 122.176 0.988 . . . . 0.0 108.603 179.141 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.583 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.04 -159.97 25.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.681 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.8 -172.1 27.64 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.784 -1.198 . . . . 0.0 110.117 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.555 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.382 -1.069 . . . . 0.0 110.578 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.699 ' O ' ' N ' ' A' ' 7' ' ' LYS . 8.3 t . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.992 0.425 . . . . 0.0 110.454 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.687 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 14.6 m-85 -103.03 163.16 12.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.005 -1.06 . . . . 0.0 109.432 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.681 ' HA ' ' HA2' ' A' ' 31' ' ' GLY . 82.1 m -139.28 119.69 13.88 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.741 -1.224 . . . . 0.0 110.677 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.665 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -84.52 139.97 31.77 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.211 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.89 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.4 m -127.39 167.07 22.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 CA-C-O 121.256 0.551 . . . . 0.0 110.032 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.582 ' ND2' HD13 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.34 89.69 3.18 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.888 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.77 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.757 -176.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.412 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.374 0.606 . . . . 0.0 110.406 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.875 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -153.78 158.88 41.57 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 111.166 178.988 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.665 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.6 m -130.48 138.79 50.44 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.745 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -108.77 143.09 38.37 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 122.033 0.92 . . . . 0.0 111.319 -178.872 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.708 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -119.01 179.52 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.65 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.736 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.593 ' N ' HG13 ' A' ' 5' ' ' ILE . 1.3 mtmp? -102.17 104.51 15.1 Favored 'General case' 0 C--N 1.295 -1.804 0 O-C-N 121.706 -0.621 . . . . 0.0 110.399 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.709 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.3 mmpt? -91.13 56.37 3.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.989 -1.07 . . . . 0.0 109.434 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.499 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -65.73 -25.29 67.23 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.329 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.499 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -68.2 -6.96 49.6 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.719 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.4 m0 -95.8 -20.04 19.15 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.303 -1.116 . . . . 0.0 110.365 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.479 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.43 142.13 9.52 Favored Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -40.7 163.71 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.538 -0.978 . . . . 0.0 110.063 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 t -94.97 151.55 19.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 110.926 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.513 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -111.26 -31.5 7.05 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.476 -0.765 . . . . 0.0 109.965 179.494 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.513 HG12 ' HG ' ' A' ' 14' ' ' LEU . 6.2 mm -119.86 -145.65 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.513 -0.742 . . . . 0.0 110.075 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.444 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 40.0 m-20 -116.37 -21.22 9.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.234 -0.916 . . . . 0.0 109.577 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.463 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -109.58 -25.11 10.62 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.482 -0.761 . . . . 0.0 109.46 179.431 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.491 ' OG1' ' CG1' ' A' ' 15' ' ' ILE . 57.9 m -40.78 -56.78 2.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.478 -0.764 . . . . 0.0 109.309 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.603 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 14.1 t -58.45 -52.64 64.76 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.305 -0.872 . . . . 0.0 109.054 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.52 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.76 -42.81 26.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.715 -0.616 . . . . 0.0 110.609 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -52.71 -60.75 2.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.947 . . . . 0.0 109.733 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.719 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.5 m -53.02 -37.88 61.87 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.391 -0.818 . . . . 0.0 109.632 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.54 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 58.2 m -60.58 -60.43 3.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.46 -0.775 . . . . 0.0 110.449 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -49.69 -61.06 2.33 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.366 -0.834 . . . . 0.0 109.59 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -47.69 -31.42 4.66 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 121.313 0.577 . . . . 0.0 110.241 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -76.46 -21.56 55.73 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.252 -0.905 . . . . 0.0 108.654 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 119.93 38.99 0.67 Allowed Glycine 0 N--CA 1.483 1.803 0 N-CA-C 108.84 -1.704 . . . . 0.0 108.84 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.587 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 37.2 m-85 -124.75 168.32 13.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.381 -1.07 . . . . 0.0 110.78 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.608 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -77.44 -28.83 16.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-O 122.177 0.989 . . . . 0.0 108.443 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.581 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.39 -159.05 24.93 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.624 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.08 178.93 36.84 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.408 ' ND2' ' HB2' ' A' ' 41' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 O-C-N 121.302 -1.117 . . . . 0.0 110.976 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.709 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.8 t . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.139 0.495 . . . . 0.0 110.928 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.708 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 12.1 m-85 -107.67 168.39 9.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 109.37 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.745 ' O ' ' HA ' ' A' ' 4' ' ' MET . 81.3 m -145.05 118.12 8.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.646 -1.284 . . . . 0.0 110.907 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.665 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -83.93 139.11 32.8 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.56 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.875 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.84 166.88 22.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 CA-C-O 121.157 0.503 . . . . 0.0 109.695 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.568 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.25 90.19 3.14 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 177.858 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.412 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.757 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.694 -176.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.488 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.8 ttp180 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.398 0.618 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.882 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -147.77 158.64 44.12 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.051 179.061 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.681 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.5 m -129.51 139.58 51.51 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 177.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.768 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 25.8 mtm -108.5 145.63 34.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 122.094 0.949 . . . . 0.0 111.715 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.673 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -121.14 179.8 2.12 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.541 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.594 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -104.25 110.83 23.19 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 110.355 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.666 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.7 mmpt? -99.89 54.82 0.93 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.114 -0.991 . . . . 0.0 109.616 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -62.57 -26.06 68.39 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.366 0.603 . . . . 0.0 110.13 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.61 -9.56 45.27 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.712 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.0 m0 -94.07 -22.48 18.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.257 -1.143 . . . . 0.0 110.344 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.22 141.15 9.2 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.52 ' CD ' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -38.73 161.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.627 -0.925 . . . . 0.0 110.392 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 13.1 t -102.32 154.39 19.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.243 -0.91 . . . . 0.0 110.623 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.548 ' HG ' HG13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.62 -31.13 8.61 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.471 -0.768 . . . . 0.0 110.113 179.79 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.548 HG13 ' HG ' ' A' ' 14' ' ' LEU . 1.8 mt -116.26 -143.66 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.437 -0.789 . . . . 0.0 110.418 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.414 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 17.9 m-20 -119.89 -15.1 8.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.48 ' O ' ' C ' ' A' ' 18' ' ' THR . 31.4 m -113.66 -29.94 6.96 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.715 -0.615 . . . . 0.0 109.778 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.504 HG21 ' CD2' ' A' ' 14' ' ' LEU . 21.9 m -40.44 -50.44 2.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.373 -0.829 . . . . 0.0 109.254 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.8 t -61.71 -45.57 93.37 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.861 0.838 . . . . 0.0 108.923 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.516 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -52.72 -41.83 64.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.753 -0.592 . . . . 0.0 110.789 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -50.85 -58.53 5.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.089 -1.007 . . . . 0.0 109.677 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.712 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 18.8 m -57.84 -36.97 73.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.456 -0.778 . . . . 0.0 109.746 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.549 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.5 m -61.57 -60.85 3.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.365 -0.834 . . . . 0.0 110.408 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.663 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 2.0 mmmt -50.64 -60.7 2.77 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.404 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.6 m-20 -47.03 -29.78 2.3 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.274 0.559 . . . . 0.0 110.482 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -79.14 -23.03 44.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.213 -0.93 . . . . 0.0 108.778 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.61 35.81 0.63 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.663 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.3 m-85 -123.94 169.49 11.56 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.297 -1.119 . . . . 0.0 110.799 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.6 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -77.77 -29.31 16.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.555 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.94 -156.69 19.3 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.667 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -159.78 -169.49 23.15 Favored Glycine 0 N--CA 1.487 2.094 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.546 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.417 0 O-C-N 121.277 -1.131 . . . . 0.0 111.003 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.666 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.5 t . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.06 0.457 . . . . 0.0 110.667 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.673 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.5 m-85 -108.44 167.82 9.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.992 . . . . 0.0 109.228 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.768 ' O ' ' HA ' ' A' ' 4' ' ' MET . 79.8 m -140.78 120.49 13.39 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.693 -1.254 . . . . 0.0 111.18 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.681 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.1 OUTLIER -85.33 138.72 32.11 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.463 179.767 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.882 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.98 166.51 21.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.572 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.37 90.64 3.23 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 178.048 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.488 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.794 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.814 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.252 0.549 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.998 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -149.24 155.85 41.23 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 119.065 -1.054 . . . . 0.0 111.83 178.819 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.683 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.3 m -130.4 139.75 50.61 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.76 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 20.8 mtm -110.43 149.82 29.74 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 122.134 0.969 . . . . 0.0 111.842 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.704 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -126.56 179.51 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.668 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.601 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -101.44 108.5 20.11 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.699 -0.626 . . . . 0.0 110.34 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.723 ' N ' ' O ' ' A' ' 40' ' ' CYS . 2.0 mptp? -95.66 55.22 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.162 -0.961 . . . . 0.0 109.652 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.52 -32.43 73.88 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.313 0.578 . . . . 0.0 110.123 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -57.77 -15.15 18.06 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.697 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 35.9 m0 -90.64 -25.04 20.31 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.309 -1.112 . . . . 0.0 110.45 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 113.77 141.77 7.95 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.491 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -42.32 168.1 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.411 -1.052 . . . . 0.0 110.261 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.406 ' SG ' ' HB ' ' A' ' 18' ' ' THR . 22.4 t -121.85 154.14 37.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.0 110.628 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.544 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -114.09 -29.43 6.99 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.507 -0.745 . . . . 0.0 110.428 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.544 HG12 ' HG ' ' A' ' 14' ' ' LEU . 1.7 mm -104.24 -145.63 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.421 -0.799 . . . . 0.0 110.623 -179.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -123.34 -26.4 4.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.567 -0.708 . . . . 0.0 109.485 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.485 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -102.04 -29.72 11.61 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.434 -0.791 . . . . 0.0 109.616 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 17' ' ' THR . 52.8 m -39.98 -45.87 1.97 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.424 -0.797 . . . . 0.0 109.357 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.9 t -73.05 -47.76 41.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.501 -0.749 . . . . 0.0 109.329 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.527 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.45 -43.53 62.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.573 -0.704 . . . . 0.0 110.787 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 m170 -49.69 -58.77 4.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.147 -0.971 . . . . 0.0 109.558 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.697 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 71.5 p -57.57 -37.75 73.68 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 0.0 109.86 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.559 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.4 m -60.77 -59.71 4.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.458 -0.776 . . . . 0.0 110.435 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 14.3 tttp -50.86 -60.35 3.16 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.313 -0.867 . . . . 0.0 109.632 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -45.95 -30.3 1.73 Allowed 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.281 0.562 . . . . 0.0 110.459 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.46 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 1.1 tpt180 -78.61 -24.09 45.56 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.224 -0.922 . . . . 0.0 108.718 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.62 40.23 0.44 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.784 -1.727 . . . . 0.0 108.784 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.637 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 27.8 m-85 -127.24 167.86 15.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.386 -1.067 . . . . 0.0 110.624 -179.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.578 HD11 ' ND2' ' A' ' 45' ' ' ASN . 0.8 OUTLIER -77.34 -28.88 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.124 0.964 . . . . 0.0 108.531 179.095 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.562 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.46 -156.84 20.1 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.637 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.49 -166.53 19.48 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.549 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.264 -1.139 . . . . 0.0 110.907 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.723 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.5 t . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.953 0.406 . . . . 0.0 110.569 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.704 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.7 m-85 -103.66 163.49 12.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.955 -1.091 . . . . 0.0 109.313 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.76 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -138.23 121.09 16.5 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.686 -1.259 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.683 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -87.63 139.88 30.09 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 119.729 -0.788 . . . . 0.0 110.704 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.998 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.85 167.62 19.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.578 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 91.3 3.24 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.906 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.793 -176.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.39 0.614 . . . . 0.0 110.384 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.895 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.47 158.85 43.17 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.21 179.034 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.683 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.4 m -129.39 138.86 51.74 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 177.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.77 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.83 145.06 40.11 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 122.024 0.916 . . . . 0.0 111.404 -178.802 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.717 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -123.36 177.94 3.7 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.595 ' HG2' ' CZ ' ' A' ' 41' ' ' TYR . 56.6 mttt -98.65 109.07 21.89 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.795 -0.565 . . . . 0.0 110.161 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.705 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -96.4 55.58 1.49 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.169 -0.957 . . . . 0.0 109.743 179.68 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -66.24 -22.3 66.32 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.094 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.486 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -69.15 -10.01 61.42 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.695 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.9 m0 -93.95 -16.16 24.23 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.189 -1.183 . . . . 0.0 110.274 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.46 140.96 9.04 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.53 ' O ' ' CD ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -40.22 162.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.445 -1.032 . . . . 0.0 110.142 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.1 t -100.09 155.19 17.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.0 110.851 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.534 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -113.61 -30.04 6.95 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.62 -0.675 . . . . 0.0 109.995 179.662 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.534 HG12 ' HG ' ' A' ' 14' ' ' LEU . 5.7 mm -120.63 -141.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.615 -0.678 . . . . 0.0 110.202 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.435 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 94.0 m-20 -124.73 -20.86 4.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.426 -0.796 . . . . 0.0 109.74 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.478 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.9 OUTLIER -107.61 -31.46 8.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.37 -0.831 . . . . 0.0 109.572 179.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.478 ' C ' ' O ' ' A' ' 17' ' ' THR . 85.0 m -40.77 -50.44 3.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.34 -0.85 . . . . 0.0 109.053 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.8 t -61.47 -50.6 72.11 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.812 0.815 . . . . 0.0 108.935 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.538 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.81 -38.67 35.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.803 -0.561 . . . . 0.0 110.512 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -55.01 -62.51 1.61 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.133 -0.979 . . . . 0.0 109.58 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.695 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -52.85 -39.24 62.39 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.423 -0.798 . . . . 0.0 109.851 179.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.546 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.6 m -57.98 -62.33 1.9 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.334 -0.854 . . . . 0.0 110.452 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.623 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 12.2 mtmt -51.13 -60.03 3.55 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.293 -0.879 . . . . 0.0 109.575 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -46.13 -30.34 1.89 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.258 0.552 . . . . 0.0 110.398 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.404 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 30.7 tpt180 -80.43 -22.81 40.79 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.25 -0.906 . . . . 0.0 108.962 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.56 42.67 0.31 Allowed Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.623 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 37.6 m-85 -130.32 169.54 15.32 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.268 -1.136 . . . . 0.0 110.778 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.572 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -80.01 -28.05 12.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 CA-C-O 122.206 1.003 . . . . 0.0 108.404 178.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.581 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.88 -159.86 25.89 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.759 -1.337 . . . . 0.0 109.759 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.63 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.04 -173.58 29.84 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.527 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.513 0 O-C-N 121.301 -1.117 . . . . 0.0 110.692 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.705 ' O ' ' N ' ' A' ' 7' ' ' LYS . 13.5 t . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 121.209 0.528 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.717 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.6 m-30 -105.37 168.82 8.82 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.139 -0.976 . . . . 0.0 109.164 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.77 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.0 m -144.42 119.32 9.95 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.775 -1.203 . . . . 0.0 110.74 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.683 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -86.59 138.72 31.46 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.696 0.76 . . . . 0.0 110.433 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.895 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.97 21.77 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 CA-C-O 121.177 0.513 . . . . 0.0 109.834 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.571 ' ND2' HD13 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.24 90.1 3.14 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 177.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.441 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.729 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.865 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.463 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.421 0.629 . . . . 0.0 110.382 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.883 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.46 158.71 42.99 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.82 . . . . 0.0 111.121 178.974 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.669 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.6 m -130.38 138.27 50.29 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.718 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 3.9 mtm -108.65 143.43 37.73 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.04 0.924 . . . . 0.0 111.275 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.725 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -122.38 179.87 2.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.616 ' CG ' ' CZ ' ' A' ' 41' ' ' TYR . 4.5 mttt -101.91 107.95 19.26 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 121.598 -0.688 . . . . 0.0 110.403 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.719 ' N ' ' O ' ' A' ' 40' ' ' CYS . 6.3 mmtm -94.74 55.4 1.89 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.079 -1.013 . . . . 0.0 109.625 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -64.26 -24.09 67.54 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.252 0.549 . . . . 0.0 110.174 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.24 -5.71 43.32 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 40.8 m0 -96.91 -19.9 18.5 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.191 -1.182 . . . . 0.0 110.451 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.492 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.78 142.02 10.1 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.537 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -39.02 161.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.592 -0.946 . . . . 0.0 110.311 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.5 t -100.99 151.74 21.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.277 -0.889 . . . . 0.0 110.77 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.493 HD21 HG23 ' A' ' 18' ' ' THR . 0.2 OUTLIER -104.98 -32.13 8.89 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.548 -0.72 . . . . 0.0 110.025 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.55 ' CD1' ' OG1' ' A' ' 18' ' ' THR . 4.3 mt -116.51 -157.79 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.501 -0.75 . . . . 0.0 110.224 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.499 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 86.7 m-20 -106.39 -14.97 14.94 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.471 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -113.57 -26.55 8.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.681 -0.637 . . . . 0.0 109.782 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.55 ' OG1' ' CD1' ' A' ' 15' ' ' ILE . 24.8 m -40.16 -58.12 1.54 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.906 . . . . 0.0 109.244 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.632 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 13.3 t -53.74 -51.56 62.94 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.362 -0.836 . . . . 0.0 109.026 178.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.575 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.39 -42.78 22.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.843 -0.536 . . . . 0.0 110.866 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 50.2 m170 -53.88 -62.4 1.68 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.074 -1.016 . . . . 0.0 109.67 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.688 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 75.7 p -51.35 -38.95 55.86 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.764 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.566 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 62.4 m -58.81 -60.94 3.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.8 . . . . 0.0 110.443 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.618 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.03 -61.48 2.13 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.344 -0.847 . . . . 0.0 109.56 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -48.78 -29.94 5.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.265 0.555 . . . . 0.0 110.391 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.52 -20.86 49.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.199 -0.938 . . . . 0.0 108.762 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.64 40.63 0.52 Allowed Glycine 0 N--CA 1.484 1.877 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.618 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 20.5 m-85 -129.42 170.23 13.94 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.239 -1.153 . . . . 0.0 110.889 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.601 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -79.11 -28.59 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.581 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.0 -158.83 24.07 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.657 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.57 -165.07 16.65 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.876 -1.289 . . . . 0.0 109.876 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.551 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.473 0 O-C-N 121.297 -1.119 . . . . 0.0 110.932 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.719 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.6 t . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 121.008 0.433 . . . . 0.0 110.593 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.725 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 6.2 m-85 -106.34 165.56 11.17 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.024 -1.047 . . . . 0.0 109.342 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.718 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.0 m -142.17 119.55 11.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.0 110.91 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.669 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -83.99 138.36 33.15 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.288 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.883 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.91 167.72 19.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 CA-C-O 121.238 0.542 . . . . 0.0 109.891 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.564 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 90.23 3.19 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.899 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.463 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.786 -176.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.485 0.66 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.848 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -162.52 159.02 24.35 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.389 -0.82 . . . . 0.0 111.223 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.648 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.7 m -130.27 138.45 50.5 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.773 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.5 OUTLIER -111.17 146.56 36.65 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 122.139 0.971 . . . . 0.0 111.536 -178.778 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.709 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -123.77 179.73 2.62 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.662 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.59 ' N ' HG13 ' A' ' 5' ' ' ILE . 1.1 mppt? -101.45 108.42 20.0 Favored 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.572 -0.705 . . . . 0.0 110.44 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 10.8 mmtm -94.77 55.69 1.92 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.127 -0.983 . . . . 0.0 109.603 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -22.3 66.7 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.202 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.94 -6.44 52.24 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.735 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.94 -24.73 16.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.274 -1.133 . . . . 0.0 110.401 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.92 141.81 6.9 Favored Glycine 0 N--CA 1.487 2.077 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.09 164.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.489 -1.006 . . . . 0.0 110.372 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.436 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 34.6 t -111.07 151.93 27.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 0.0 110.685 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.536 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.27 -31.32 8.68 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.496 -0.753 . . . . 0.0 110.088 179.766 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.536 HG12 ' HG ' ' A' ' 14' ' ' LEU . 3.3 mm -117.19 -145.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.475 -0.765 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.424 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 15.5 m-20 -119.38 -26.43 5.83 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.525 -0.734 . . . . 0.0 109.338 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.5 m -98.74 -32.33 11.44 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.503 -0.748 . . . . 0.0 109.559 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.454 ' C ' ' O ' ' A' ' 17' ' ' THR . 94.1 m -40.62 -45.82 2.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.36 -0.838 . . . . 0.0 109.236 179.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.608 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 9.1 t -68.53 -48.01 65.44 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.773 0.797 . . . . 0.0 109.14 178.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.545 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -50.64 -36.81 37.23 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 110.49 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -54.58 -62.72 1.47 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.133 -0.979 . . . . 0.0 109.549 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.735 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.5 m -53.31 -39.66 64.19 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.446 -0.784 . . . . 0.0 109.717 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.553 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.1 m -57.59 -62.1 2.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 110.509 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.619 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 24.3 ttpt -49.55 -61.31 2.18 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.33 -0.856 . . . . 0.0 109.469 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -47.47 -29.6 2.83 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.2 0.524 . . . . 0.0 110.499 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -79.25 -20.88 47.08 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.176 -0.952 . . . . 0.0 108.756 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.16 37.79 0.68 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.619 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 11.2 m-85 -124.31 168.0 13.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.367 -1.078 . . . . 0.0 110.457 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.603 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -76.7 -28.79 17.65 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-O 122.21 1.005 . . . . 0.0 108.31 178.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.577 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 176.99 -159.1 25.32 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.632 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.18 -179.75 36.1 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.558 ' OD1' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -140.39 172.86 12.13 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.331 -1.1 . . . . 0.0 110.721 179.585 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.558 ' N ' ' OD1' ' A' ' 32' ' ' ASN . 59.5 m -129.17 102.33 6.42 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -78.84 120.3 23.26 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.305 -0.872 . . . . 0.0 110.43 -179.152 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.474 ' O ' ' NE ' ' A' ' 38' ' ' ARG . . . -71.55 -36.67 62.43 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.333 -1.507 . . . . 0.0 109.333 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 43.3 ttm -52.35 -35.01 50.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.255 -1.144 . . . . 0.0 110.002 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.443 ' O ' ' C ' ' A' ' 38' ' ' ARG . 36.3 p -128.05 9.45 6.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.282 -0.886 . . . . 0.0 110.274 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 34' ' ' LYS . 11.2 mmt180 40.98 55.9 3.05 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.304 -0.873 . . . . 0.0 110.118 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.6 m -122.63 162.04 22.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.264 -0.897 . . . . 0.0 110.499 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 5.8 t -100.61 125.16 46.97 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.413 -0.804 . . . . 0.0 110.954 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.709 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-85 -105.83 167.2 9.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 109.548 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.773 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.3 m -143.59 119.51 10.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.706 -1.246 . . . . 0.0 110.891 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -85.04 140.81 30.73 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.732 0.777 . . . . 0.0 110.633 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.848 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -127.33 166.64 23.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.14 0.495 . . . . 0.0 109.84 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.58 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.27 89.95 3.15 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 177.92 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.779 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.742 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.401 0.62 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.881 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -157.59 158.36 35.42 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.909 0.862 . . . . 0.0 111.329 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.648 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.8 m -131.06 139.17 49.87 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.75 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.6 OUTLIER -109.75 145.95 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 122.038 0.923 . . . . 0.0 111.409 -178.829 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.715 HG13 ' N ' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -122.27 179.02 2.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.938 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.715 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -98.02 108.44 21.14 Favored 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.462 -179.938 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -98.27 55.45 1.13 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.119 -0.988 . . . . 0.0 109.661 179.556 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.477 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -67.15 -26.75 66.81 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.319 0.58 . . . . 0.0 110.103 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.477 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -61.78 -12.67 36.06 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.693 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 36.8 m0 -91.98 -17.97 24.36 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.266 -1.138 . . . . 0.0 110.303 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.469 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 108.0 140.04 9.19 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -40.93 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.591 -0.946 . . . . 0.0 110.122 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 12.8 t -110.22 151.53 27.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.188 -0.945 . . . . 0.0 110.77 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.576 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.71 -31.25 8.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.571 -0.706 . . . . 0.0 109.965 179.666 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.576 HG12 ' HG ' ' A' ' 14' ' ' LEU . 4.0 mm -109.93 -143.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.568 -0.708 . . . . 0.0 110.127 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.43 ' OD1' ' C ' ' A' ' 15' ' ' ILE . 25.8 m-20 -125.69 -20.8 4.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.369 -0.832 . . . . 0.0 109.876 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.486 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.3 m -105.13 -30.18 9.9 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.34 -0.85 . . . . 0.0 109.752 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.486 ' C ' ' O ' ' A' ' 17' ' ' THR . 1.0 OUTLIER -39.74 -53.99 2.14 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.288 -0.882 . . . . 0.0 109.205 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.593 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.2 t -58.74 -51.53 69.57 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.358 -0.839 . . . . 0.0 109.072 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.577 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.39 -41.21 19.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.804 -0.56 . . . . 0.0 110.804 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -54.29 -61.71 2.13 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.103 -0.998 . . . . 0.0 109.766 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.693 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -53.74 -37.53 63.45 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.398 -0.814 . . . . 0.0 110.03 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.57 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 63.6 m -58.43 -61.88 2.26 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.341 -0.85 . . . . 0.0 110.635 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.656 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 6.0 mtpt -50.69 -60.68 2.8 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.305 -0.872 . . . . 0.0 109.6 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -47.16 -29.69 2.45 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.182 0.515 . . . . 0.0 110.472 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 0.3 OUTLIER -79.6 -23.49 42.66 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.256 -0.903 . . . . 0.0 108.815 179.42 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.25 41.15 0.37 Allowed Glycine 0 N--CA 1.484 1.846 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.656 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 27.7 m-85 -129.44 169.2 15.23 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.276 -1.132 . . . . 0.0 110.592 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.593 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -78.99 -28.3 13.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 122.19 0.995 . . . . 0.0 108.371 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.577 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.91 -158.57 23.69 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.663 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.48 -162.22 12.25 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.561 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -153.36 176.64 11.77 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.305 -1.115 . . . . 0.0 111.01 -179.874 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.573 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 78.8 m -136.52 95.14 3.1 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.528 ' O ' ' N ' ' A' ' 38' ' ' ARG . 1.4 mmtt -79.31 123.12 27.16 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.131 -0.981 . . . . 0.0 110.716 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -77.44 -34.81 39.05 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.0 mtt -60.84 -38.43 85.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.362 -1.081 . . . . 0.0 109.735 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.506 ' CG2' ' HB3' ' A' ' 34' ' ' LYS . 8.8 t -116.12 4.51 13.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.358 -0.839 . . . . 0.0 109.977 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 34' ' ' LYS . 2.9 mtp180 39.05 56.63 2.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.384 -0.822 . . . . 0.0 110.009 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.07 157.93 39.37 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.285 -0.885 . . . . 0.0 110.654 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t -99.91 116.86 32.95 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.495 -0.753 . . . . 0.0 110.558 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.697 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.5 m-30 -99.45 163.16 12.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.001 -1.062 . . . . 0.0 109.649 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.75 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.7 m -140.09 119.09 12.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.816 -1.177 . . . . 0.0 110.763 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.648 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -83.68 139.91 32.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.537 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.881 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.46 166.79 22.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-O 121.207 0.527 . . . . 0.0 109.801 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.588 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.34 90.03 3.19 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 177.795 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.723 -176.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.42 0.629 . . . . 0.0 110.375 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.896 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.95 158.09 41.57 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.377 -0.827 . . . . 0.0 111.085 178.882 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.639 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.6 m -129.18 138.8 51.95 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.739 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 18.5 mtm -109.85 146.19 35.5 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.113 0.959 . . . . 0.0 111.484 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.679 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -124.28 179.53 2.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.708 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.573 ' N ' HG13 ' A' ' 5' ' ' ILE . 8.0 mttt -101.37 109.23 21.03 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 121.634 -0.666 . . . . 0.0 110.336 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.688 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -93.83 55.24 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.105 -0.997 . . . . 0.0 109.511 179.503 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.54 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.9 OUTLIER -65.49 -28.99 69.59 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.323 0.582 . . . . 0.0 110.173 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.54 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -63.14 -11.07 37.13 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 37.2 m0 -93.72 -19.38 21.13 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.257 -1.143 . . . . 0.0 110.247 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 105.69 141.35 10.54 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.462 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -38.61 154.89 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.575 -0.956 . . . . 0.0 110.087 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.446 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 31.7 t -94.27 150.06 20.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.144 -0.972 . . . . 0.0 110.58 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.544 HD12 ' CG1' ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.46 -31.2 8.65 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.463 -0.773 . . . . 0.0 110.034 179.729 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.544 ' CG1' HD12 ' A' ' 14' ' ' LEU . 2.4 mm -115.15 -155.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.494 -0.754 . . . . 0.0 110.321 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.407 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.35 -26.1 11.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.688 179.666 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.492 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.3 OUTLIER -104.0 -28.95 11.23 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.457 -0.777 . . . . 0.0 109.638 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.492 ' C ' ' O ' ' A' ' 17' ' ' THR . 3.0 m -39.02 -55.4 1.58 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.376 -0.828 . . . . 0.0 109.358 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.588 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -58.19 -52.28 66.21 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.342 -0.849 . . . . 0.0 108.977 178.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.46 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.87 -42.25 47.32 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.704 -0.622 . . . . 0.0 110.441 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -51.42 -59.05 4.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 0.0 109.709 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.688 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -57.35 -37.42 72.56 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.369 -0.832 . . . . 0.0 109.966 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.538 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.9 m -59.83 -60.06 4.44 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.259 -0.901 . . . . 0.0 110.568 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' O ' ' N ' ' A' ' 27' ' ' GLY . 16.9 mtpt -51.46 -60.76 2.78 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.637 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -43.52 -29.81 0.51 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.147 0.498 . . . . 0.0 110.686 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.577 ' HG2' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -79.79 -28.44 40.28 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.217 -0.927 . . . . 0.0 108.703 179.39 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 129.75 37.57 0.36 Allowed Glycine 0 N--CA 1.484 1.865 0 N-CA-C 108.678 -1.769 . . . . 0.0 108.678 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.577 ' CE2' ' HG2' ' A' ' 26' ' ' ARG . 20.5 m-85 -121.48 168.11 12.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.334 -1.098 . . . . 0.0 110.697 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.6 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -78.83 -28.12 13.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-O 122.102 0.953 . . . . 0.0 108.564 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.568 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.66 -160.3 26.8 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.578 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.31 172.53 37.56 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.613 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -128.37 161.93 28.29 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.081 -1.246 . . . . 0.0 111.053 -179.871 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.49 ' SG ' ' O ' ' A' ' 15' ' ' ILE . 70.1 m -122.71 98.94 6.14 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.522 ' O ' ' N ' ' A' ' 38' ' ' ARG . 11.7 mttt -79.58 118.96 21.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.21 -0.931 . . . . 0.0 110.701 -179.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -75.1 -36.69 45.3 Favored Glycine 0 N--CA 1.489 2.195 0 N-CA-C 108.967 -1.653 . . . . 0.0 108.967 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.1 ttp -66.2 -26.4 67.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.342 -1.093 . . . . 0.0 110.09 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.49 ' OG1' ' HB3' ' A' ' 34' ' ' LYS . 7.0 p -119.41 0.04 11.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.275 -0.891 . . . . 0.0 110.066 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 34' ' ' LYS . 33.9 mtt180 40.89 54.95 3.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.34 -0.85 . . . . 0.0 110.218 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' A' ' 37' ' ' THR . 2.2 m -135.18 151.56 50.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.402 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.688 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.3 t -97.01 129.74 44.43 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.358 -0.839 . . . . 0.0 110.84 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.679 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 8.6 m-85 -109.99 169.27 8.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.12 -0.987 . . . . 0.0 109.133 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.739 ' O ' ' HA ' ' A' ' 4' ' ' MET . 86.2 m -143.99 118.98 9.99 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.701 -1.249 . . . . 0.0 110.725 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.639 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -85.83 139.04 31.62 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.486 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.896 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.24 23.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.577 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.23 89.82 3.12 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.431 ' O ' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.766 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.789 -176.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.498 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.487 0.66 . . . . 0.0 110.462 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.88 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.65 159.02 43.21 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.396 -0.815 . . . . 0.0 110.882 178.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.668 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.5 m -129.41 138.5 51.52 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.752 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.2 OUTLIER -110.15 142.66 41.35 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-O 122.051 0.929 . . . . 0.0 111.248 -178.888 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.724 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -120.9 178.14 2.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.584 ' N ' HG13 ' A' ' 5' ' ' ILE . 8.7 mttp -98.96 108.78 21.55 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.794 -0.566 . . . . 0.0 110.075 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.702 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.7 OUTLIER -98.1 55.68 1.17 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.118 -0.989 . . . . 0.0 109.873 179.764 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -21.3 64.72 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.279 0.561 . . . . 0.0 110.071 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.54 -6.84 51.43 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.744 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.281 -1.129 . . . . 0.0 110.215 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 108.77 140.68 9.18 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.29 155.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.458 -1.025 . . . . 0.0 110.173 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.467 ' N ' ' O ' ' A' ' 38' ' ' ARG . 35.5 t -100.22 153.28 19.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.173 -0.955 . . . . 0.0 110.762 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.525 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -107.35 -31.41 8.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.562 -0.711 . . . . 0.0 109.985 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.525 HG12 ' HG ' ' A' ' 14' ' ' LEU . 2.9 mm -117.37 -150.8 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.487 -0.758 . . . . 0.0 110.274 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.405 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 4.5 m-20 -113.44 -26.13 8.47 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.443 -0.785 . . . . 0.0 109.427 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.469 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -99.21 -29.76 12.65 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.5 -0.75 . . . . 0.0 109.487 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.473 ' OG1' ' CG1' ' A' ' 15' ' ' ILE . 90.0 m -40.38 -49.72 2.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.38 -0.825 . . . . 0.0 109.276 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -64.31 -50.53 67.45 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.345 -0.847 . . . . 0.0 109.073 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.55 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.81 -39.64 18.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.734 -0.604 . . . . 0.0 110.662 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 10.2 m170 -53.03 -61.34 2.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.212 -0.93 . . . . 0.0 109.677 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.744 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.8 m -55.84 -38.75 70.47 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.459 -0.776 . . . . 0.0 109.87 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.533 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.3 m -58.8 -61.86 2.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.331 -0.856 . . . . 0.0 110.313 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.5 OUTLIER -50.66 -61.17 2.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.386 -0.821 . . . . 0.0 109.628 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -51.16 -27.6 9.04 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.15 0.5 . . . . 0.0 110.502 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -78.52 -22.43 47.36 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.2 -0.938 . . . . 0.0 108.677 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.36 38.54 0.51 Allowed Glycine 0 N--CA 1.484 1.871 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.628 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.2 m-85 -128.56 170.9 12.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.258 -1.142 . . . . 0.0 110.641 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.588 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -77.87 -28.32 15.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 CA-C-O 122.199 1.0 . . . . 0.0 108.433 179.197 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.568 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.0 -157.74 22.97 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.676 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.54 -166.2 18.87 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.57 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -154.58 177.15 11.53 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.292 -1.122 . . . . 0.0 110.686 179.947 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.54 ' N ' ' CG ' ' A' ' 32' ' ' ASN . 60.9 m -138.22 119.65 14.85 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 38' ' ' ARG . 22.0 tttt -79.06 167.55 20.9 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.176 -0.952 . . . . 0.0 110.554 -179.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -108.83 -30.04 3.87 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.7 mtt -68.15 -23.6 64.9 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.226 -1.161 . . . . 0.0 110.027 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.42 ' O ' ' C ' ' A' ' 38' ' ' ARG . 0.7 OUTLIER -143.68 9.76 1.58 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.309 -0.869 . . . . 0.0 110.186 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.551 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 0.3 OUTLIER 41.46 53.65 3.7 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.33 -0.856 . . . . 0.0 110.164 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.485 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 2.2 m -95.84 -168.83 1.83 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 110.335 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.702 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.5 t -133.25 123.49 25.64 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.394 -0.816 . . . . 0.0 110.544 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.724 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.9 m-85 -108.5 166.65 10.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.009 -1.057 . . . . 0.0 109.515 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.752 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.16 120.15 12.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.774 -1.204 . . . . 0.0 110.713 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.668 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -85.68 137.61 32.71 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.462 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.88 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.97 166.47 22.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.177 0.513 . . . . 0.0 109.774 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.564 ' ND2' HD13 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.19 90.58 3.12 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.929 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.498 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.756 -176.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.503 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.413 0.625 . . . . 0.0 110.418 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.91 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -150.04 158.08 43.8 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.073 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.667 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.5 m -128.59 138.71 52.35 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.761 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.04 143.06 40.6 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 122.064 0.935 . . . . 0.0 111.569 -178.784 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.713 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -120.54 -179.85 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.795 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.597 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -103.06 110.59 22.57 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 121.744 -0.598 . . . . 0.0 110.418 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.703 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.3 OUTLIER -100.69 54.81 0.87 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.044 -1.035 . . . . 0.0 109.692 179.428 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -23.6 67.41 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.285 0.564 . . . . 0.0 110.058 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.96 -7.71 44.79 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.699 ' CE3' ' OG ' ' A' ' 22' ' ' SER . 38.8 m0 -95.47 -19.52 19.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.252 -1.146 . . . . 0.0 110.295 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 106.93 140.86 9.87 Favored Glycine 0 N--CA 1.488 2.125 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.507 ' CD ' ' N ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -39.28 160.65 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.994 . . . . 0.0 110.282 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 14.1 t -103.05 152.82 20.92 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.242 -0.911 . . . . 0.0 110.597 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.544 HD13 ' CD1' ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.61 -30.89 9.21 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 110.064 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.544 ' CD1' HD13 ' A' ' 14' ' ' LEU . 3.5 mm -116.77 -148.41 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.525 -0.734 . . . . 0.0 110.283 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.437 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 8.9 m-20 -114.58 -25.81 8.17 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.465 -0.772 . . . . 0.0 109.396 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.49 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -101.92 -29.85 11.58 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.565 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.49 ' C ' ' O ' ' A' ' 17' ' ' THR . 4.4 m -39.42 -53.4 2.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.385 -0.822 . . . . 0.0 109.294 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.575 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 5.5 t -60.24 -46.14 90.83 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.376 -0.827 . . . . 0.0 109.038 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.538 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.53 -39.52 64.73 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.689 -0.632 . . . . 0.0 110.362 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.56 -59.21 4.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.174 -0.954 . . . . 0.0 109.617 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.699 ' OG ' ' CE3' ' A' ' 10' ' ' TRP . 9.0 t -58.44 -36.66 73.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.432 -0.792 . . . . 0.0 110.033 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.538 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 70.0 m -61.35 -60.86 3.07 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.316 -0.865 . . . . 0.0 110.443 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.593 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -52.56 -59.61 4.24 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.411 -0.806 . . . . 0.0 109.808 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -44.17 -30.06 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.228 0.537 . . . . 0.0 110.504 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.452 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 3.1 ttm-85 -79.72 -28.85 40.51 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.163 -0.961 . . . . 0.0 108.798 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 132.07 39.21 0.24 Allowed Glycine 0 N--CA 1.483 1.825 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.593 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.1 m-85 -125.23 170.09 11.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.375 -1.074 . . . . 0.0 110.692 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.6 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -79.56 -28.47 13.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.117 0.96 . . . . 0.0 108.502 179.124 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.564 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.27 -158.59 24.22 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.596 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.77 172.48 37.11 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.609 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -124.18 162.15 24.23 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.181 -1.188 . . . . 0.0 110.879 -179.855 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 78.3 m -122.84 96.51 5.05 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HB3' ' OG1' ' A' ' 37' ' ' THR . 0.8 OUTLIER -79.4 130.26 35.25 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.209 -0.932 . . . . 0.0 110.614 -179.214 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.529 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -85.55 -40.87 7.57 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -33.74 75.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -1.136 . . . . 0.0 109.762 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.47 ' O ' ' C ' ' A' ' 38' ' ' ARG . 30.1 p -111.02 -1.2 16.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.368 -0.833 . . . . 0.0 110.051 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 35' ' ' GLY . 1.3 mtm-85 40.15 55.4 2.69 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.863 . . . . 0.0 110.055 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' A' ' 37' ' ' THR . 0.4 OUTLIER -133.07 153.61 51.34 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.26 -0.9 . . . . 0.0 110.409 -179.81 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.703 ' O ' ' N ' ' A' ' 7' ' ' LYS . 3.1 t -98.92 127.42 44.84 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.526 -0.733 . . . . 0.0 110.76 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.713 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.3 m-85 -107.62 168.87 8.95 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.067 -1.02 . . . . 0.0 108.714 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.761 ' O ' ' HA ' ' A' ' 4' ' ' MET . 78.1 m -141.0 119.69 12.48 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.703 -1.248 . . . . 0.0 111.053 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.667 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -85.34 136.6 33.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.745 0.783 . . . . 0.0 110.224 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.91 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.0 165.62 23.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.572 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -75.84 90.65 2.93 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 106.606 -1.627 . . . . 0.0 106.606 177.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.503 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.752 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.791 -176.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.463 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.403 0.621 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.85 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -158.03 159.66 36.61 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.339 -0.85 . . . . 0.0 111.308 179.129 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.681 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.4 m -129.07 139.28 52.08 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.745 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -110.13 146.36 35.61 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.012 0.911 . . . . 0.0 111.609 -178.621 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.66 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -121.99 179.59 2.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.591 ' HG2' ' CZ ' ' A' ' 41' ' ' TYR . 6.3 mttp -100.63 108.97 21.0 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.74 -0.6 . . . . 0.0 110.597 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.697 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -95.37 56.0 1.8 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.092 -1.005 . . . . 0.0 109.592 179.316 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.478 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -69.65 -18.66 63.6 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.4 179.989 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.478 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -77.93 -0.79 76.83 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.726 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 42.1 m0 -100.84 -15.47 17.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -1.169 . . . . 0.0 110.251 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.89 141.44 9.8 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.3 165.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.461 -1.023 . . . . 0.0 110.19 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.48 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 12.3 t -107.84 153.75 22.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.135 -0.978 . . . . 0.0 110.89 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.551 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -108.33 -30.74 8.17 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 121.556 0.693 . . . . 0.0 110.006 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.551 HG12 ' HG ' ' A' ' 14' ' ' LEU . 3.6 mm -119.52 -147.92 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.556 -0.715 . . . . 0.0 110.351 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.42 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 21.1 m-20 -116.12 -25.6 7.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.43 -0.794 . . . . 0.0 109.372 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.64 -30.0 12.72 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.472 -0.767 . . . . 0.0 109.536 179.328 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.473 ' C ' ' O ' ' A' ' 17' ' ' THR . 44.9 m -41.05 -54.59 2.77 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.339 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.621 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.0 t -60.23 -49.99 75.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.306 -0.871 . . . . 0.0 109.076 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.528 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.65 -41.55 43.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.739 -0.601 . . . . 0.0 110.715 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -51.51 -59.83 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.714 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.726 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.5 m -56.35 -37.48 70.07 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.405 -0.809 . . . . 0.0 109.817 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.535 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.0 m -59.32 -61.99 2.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.431 -0.793 . . . . 0.0 110.526 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 7.8 mtpt -50.25 -60.22 3.19 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.418 -0.801 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.05 -30.0 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.312 0.577 . . . . 0.0 110.139 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.4 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 36.8 tpt85 -78.58 -21.38 48.72 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.333 -0.855 . . . . 0.0 108.822 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 122.03 40.81 0.5 Allowed Glycine 0 N--CA 1.484 1.837 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.628 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.8 m-85 -128.81 169.53 14.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -1.083 . . . . 0.0 110.654 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.589 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.9 OUTLIER -78.58 -28.82 14.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.553 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.43 -157.33 21.1 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.657 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.23 -165.86 17.93 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.569 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -151.7 175.74 12.08 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.185 -1.185 . . . . 0.0 110.953 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.523 ' N ' ' CG ' ' A' ' 32' ' ' ASN . 60.0 m -138.11 116.25 11.76 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.494 ' O ' ' HA ' ' A' ' 38' ' ' ARG . 11.0 mmmm -78.94 178.82 7.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.171 -0.956 . . . . 0.0 110.511 -179.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.476 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -117.39 -51.89 0.34 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.9 mtt -53.97 -33.37 56.74 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.298 -1.119 . . . . 0.0 109.964 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.45 HG22 ' OG1' ' A' ' 39' ' ' THR . 5.1 t -125.0 0.4 7.93 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.356 -0.84 . . . . 0.0 110.156 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.542 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 0.8 OUTLIER 41.13 54.82 3.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.296 -0.877 . . . . 0.0 110.251 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.494 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 3.1 m -100.85 -176.32 3.14 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.881 . . . . 0.0 110.35 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.697 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.9 t -123.81 126.16 45.97 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.282 -0.886 . . . . 0.0 110.749 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.66 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 4.6 m-85 -110.17 167.1 10.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.1 -1.0 . . . . 0.0 109.352 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.745 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.9 m -141.6 119.34 11.78 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.648 -1.282 . . . . 0.0 110.834 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.681 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -86.21 139.96 30.57 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.793 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.85 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.53 166.89 22.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.181 0.515 . . . . 0.0 109.707 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.582 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 90.35 3.19 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 177.954 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.786 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.415 0.626 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.875 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -160.49 158.6 29.58 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.832 0.825 . . . . 0.0 111.222 178.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.668 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.6 m -129.32 138.38 51.54 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.75 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.9 OUTLIER -110.17 141.26 43.33 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-O 122.091 0.948 . . . . 0.0 111.272 -178.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.735 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -119.87 179.44 2.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.798 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.609 ' HG3' ' CZ ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -102.48 105.39 15.93 Favored 'General case' 0 C--N 1.294 -1.81 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.706 ' N ' ' O ' ' A' ' 40' ' ' CYS . 43.3 mmtt -92.05 56.47 2.87 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.968 -1.082 . . . . 0.0 109.561 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.488 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.7 OUTLIER -64.93 -24.88 67.66 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.169 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.488 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -67.24 -7.9 47.53 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.738 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.2 m0 -94.78 -17.27 22.3 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -1.165 . . . . 0.0 110.335 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.65 140.59 8.2 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.4 OUTLIER -44.84 157.35 0.07 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.431 -1.041 . . . . 0.0 109.836 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 18.0 t -105.59 152.35 23.2 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.115 -0.99 . . . . 0.0 111.087 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.527 ' CG ' HD12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -111.92 -30.59 7.22 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.553 0.692 . . . . 0.0 109.934 179.471 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.561 ' CD1' ' N ' ' A' ' 15' ' ' ILE . 1.5 mm -107.2 -148.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.502 -0.749 . . . . 0.0 110.466 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -122.55 -25.24 4.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.383 -0.823 . . . . 0.0 109.677 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.482 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -103.07 -29.89 11.08 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.4 -0.812 . . . . 0.0 109.512 179.505 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.482 ' C ' ' O ' ' A' ' 17' ' ' THR . 18.4 m -40.59 -47.4 2.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.302 -0.874 . . . . 0.0 109.092 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.629 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.2 t -66.9 -50.33 62.78 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-O 121.793 0.806 . . . . 0.0 109.112 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.51 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -48.17 -39.83 22.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.704 -0.623 . . . . 0.0 110.519 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.407 ' C ' ' CD2' ' A' ' 21' ' ' HIS . 3.7 t-160 -54.37 -61.74 2.11 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.194 -0.942 . . . . 0.0 109.595 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.738 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.3 m -52.81 -39.16 62.14 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.371 -0.831 . . . . 0.0 109.74 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.521 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 57.7 m -57.6 -62.05 2.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.662 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLY . 9.5 mtpt -49.39 -61.02 2.33 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.383 -0.823 . . . . 0.0 109.278 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m-20 -45.79 -31.41 2.04 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.189 0.519 . . . . 0.0 110.347 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -20.65 48.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.265 -0.897 . . . . 0.0 108.814 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 120.21 40.85 0.57 Allowed Glycine 0 N--CA 1.484 1.856 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.575 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 34.8 m-85 -126.59 168.47 14.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.37 -1.077 . . . . 0.0 110.696 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.6 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -78.56 -28.44 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 CA-C-O 122.141 0.972 . . . . 0.0 108.553 179.196 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.588 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.99 -159.2 24.72 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.639 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.65 -162.52 12.61 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.578 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -158.64 175.42 13.66 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.235 -1.156 . . . . 0.0 110.893 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.498 ' N ' ' CG ' ' A' ' 32' ' ' ASN . 58.4 m -133.18 116.8 16.68 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.536 ' O ' ' HA ' ' A' ' 38' ' ' ARG . 2.0 mmtt -79.17 169.32 18.33 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.158 -0.964 . . . . 0.0 110.832 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -111.48 -49.22 0.66 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.199 -1.561 . . . . 0.0 109.199 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.1 mmt -63.22 -25.11 68.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.243 -1.151 . . . . 0.0 109.78 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.524 ' CG2' ' HB3' ' A' ' 34' ' ' LYS . 11.2 t -124.03 -6.11 7.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.415 -0.803 . . . . 0.0 110.087 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.538 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER 41.87 56.02 3.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 109.88 -179.99 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.479 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 10.5 m -115.12 172.41 7.08 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.364 -0.835 . . . . 0.0 110.322 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.706 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t -109.22 124.98 51.75 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.435 -0.791 . . . . 0.0 110.871 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.735 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 11.4 m-85 -106.86 169.94 8.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.116 -0.99 . . . . 0.0 109.395 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.75 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.5 m -146.6 119.02 8.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.645 -1.285 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.668 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -84.9 138.5 32.48 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.652 0.739 . . . . 0.0 110.364 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.875 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.73 166.68 22.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-O 121.136 0.493 . . . . 0.0 109.796 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.566 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.21 89.72 3.11 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.815 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.44 ' OXT' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.753 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.796 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.43 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.3 ttp180 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.365 0.602 . . . . 0.0 110.381 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.913 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -151.85 157.8 42.38 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.232 178.969 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.637 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.6 m -129.82 139.1 51.3 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.798 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.99 144.5 41.22 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-O 122.097 0.951 . . . . 0.0 111.589 -178.727 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.668 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -123.32 179.36 2.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.704 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.603 ' HA ' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -97.63 112.03 24.07 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.556 -0.715 . . . . 0.0 110.456 -179.918 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.665 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -94.3 54.69 1.9 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.075 -1.016 . . . . 0.0 109.699 179.606 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.437 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.1 OUTLIER -70.28 -26.73 63.94 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.36 0.6 . . . . 0.0 110.1 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.437 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -65.19 -9.84 44.13 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.731 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.06 -16.72 22.46 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.338 -1.095 . . . . 0.0 110.337 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.504 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 110.73 141.81 8.92 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.504 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -34.23 151.45 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.646 -0.914 . . . . 0.0 110.304 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 15' ' ' ILE . 17.9 t -95.69 152.19 18.68 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.302 -0.874 . . . . 0.0 110.706 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.513 ' C ' ' CD1' ' A' ' 15' ' ' ILE . 0.2 OUTLIER -115.05 -31.7 5.96 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.521 -0.737 . . . . 0.0 110.731 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.522 ' CG1' ' OG1' ' A' ' 18' ' ' THR . 3.4 mm -128.22 169.18 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.217 -0.927 . . . . 0.0 111.065 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.563 ' HA ' ' HB2' ' A' ' 33' ' ' CYS . 20.7 m-20 -75.22 -21.21 58.81 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.444 -0.785 . . . . 0.0 110.453 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.471 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.1 OUTLIER -106.62 -39.97 5.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.197 -0.939 . . . . 0.0 109.643 179.781 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.522 ' OG1' ' CG1' ' A' ' 15' ' ' ILE . 99.0 m -41.24 -39.05 1.25 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.273 -0.892 . . . . 0.0 108.654 179.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.572 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 6.2 t -71.54 -49.35 41.56 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.519 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.95 -35.94 62.3 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.749 -0.594 . . . . 0.0 110.307 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -53.6 -61.84 2.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.253 -0.905 . . . . 0.0 109.328 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.731 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 14.5 m -54.94 -41.94 71.67 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.41 -0.806 . . . . 0.0 109.505 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.539 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.4 m -56.29 -61.87 2.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.319 -0.863 . . . . 0.0 110.413 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 15.8 mtmt -50.1 -61.12 2.34 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.418 -0.801 . . . . 0.0 109.629 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -47.35 -29.52 2.61 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.211 0.529 . . . . 0.0 110.504 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -22.05 45.15 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.216 -0.928 . . . . 0.0 108.846 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 123.32 37.88 0.58 Allowed Glycine 0 N--CA 1.484 1.886 0 N-CA-C 108.802 -1.719 . . . . 0.0 108.802 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.592 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 6.8 m-85 -123.74 169.69 11.26 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -1.076 . . . . 0.0 110.463 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.612 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.9 OUTLIER -80.45 -28.08 11.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 CA-C-O 122.202 1.001 . . . . 0.0 108.343 178.88 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.561 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.93 -159.46 24.42 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.593 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.41 172.36 36.8 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.612 ' C ' ' OD1' ' A' ' 32' ' ' ASN . 0.2 OUTLIER -129.68 162.82 27.47 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.016 -1.285 . . . . 0.0 111.458 -179.373 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.563 ' HB2' ' HA ' ' A' ' 16' ' ' ASP . 1.4 t -112.8 97.74 6.75 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.537 ' O ' ' CA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -79.71 117.51 20.67 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.055 -1.028 . . . . 0.0 110.495 -179.487 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.461 ' O ' ' C ' ' A' ' 36' ' ' MET . . . -76.06 -44.81 17.51 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.461 ' C ' ' O ' ' A' ' 35' ' ' GLY . 0.3 OUTLIER -40.85 -43.62 2.09 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.319 -1.107 . . . . 0.0 109.923 179.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.7 t -124.16 9.39 8.63 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.345 -0.847 . . . . 0.0 109.926 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.537 ' CA ' ' O ' ' A' ' 34' ' ' LYS . 0.9 OUTLIER 45.34 52.26 8.97 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.354 -0.841 . . . . 0.0 110.083 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 m -119.19 151.1 38.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.257 -0.902 . . . . 0.0 110.375 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.665 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.2 t -93.76 132.69 37.9 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.469 -0.77 . . . . 0.0 111.053 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.668 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-30 -110.72 168.75 9.24 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 108.762 178.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.798 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -142.0 118.54 10.96 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.717 -1.239 . . . . 0.0 110.776 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.637 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -85.24 137.89 32.7 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.218 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.913 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.88 166.63 21.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.139 0.495 . . . . 0.0 109.799 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.565 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.26 89.76 3.14 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.774 -176.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.42 ' C ' ' OG1' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.458 0.647 . . . . 0.0 110.442 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.851 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -167.53 159.28 12.05 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.792 0.806 . . . . 0.0 111.231 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.653 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.7 m -130.42 139.09 50.61 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.751 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 46.4 mtm -108.01 143.75 36.27 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.12 0.962 . . . . 0.0 111.548 -178.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.703 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -118.49 179.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.645 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.58 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.15 107.92 19.46 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.656 -0.652 . . . . 0.0 110.365 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.69 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -95.11 55.7 1.83 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.128 -0.982 . . . . 0.0 109.523 179.408 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.37 -17.19 64.18 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.256 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.24 -4.3 78.65 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.743 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 40.4 m0 -97.55 -24.71 15.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.389 -1.065 . . . . 0.0 110.337 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.34 142.0 7.08 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -40.59 163.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.503 -0.998 . . . . 0.0 110.281 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 49.1 t -105.43 151.87 23.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.189 -0.945 . . . . 0.0 110.788 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.537 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -107.35 -31.57 8.13 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.468 -0.77 . . . . 0.0 109.972 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.537 HG12 ' HG ' ' A' ' 14' ' ' LEU . 4.2 mm -120.87 -147.23 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.517 -0.739 . . . . 0.0 110.26 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.44 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 0.9 OUTLIER -114.38 -26.66 7.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.437 -0.79 . . . . 0.0 109.241 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.449 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.68 -30.97 12.15 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.487 -0.758 . . . . 0.0 109.577 179.534 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.501 HG21 ' CD2' ' A' ' 14' ' ' LEU . 25.8 m -40.83 -47.96 3.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.381 -0.824 . . . . 0.0 109.29 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.598 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.3 t -67.33 -48.59 67.1 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.376 -0.827 . . . . 0.0 109.117 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.538 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.53 -38.51 54.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.692 -0.63 . . . . 0.0 110.534 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.09 -59.98 3.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.165 -0.959 . . . . 0.0 109.622 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.743 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.8 m -57.58 -38.87 75.58 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.382 -0.824 . . . . 0.0 109.706 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.541 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.5 m -60.13 -61.6 2.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.96 -61.0 2.49 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.607 179.9 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -51.04 -27.94 9.11 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-O 121.175 0.512 . . . . 0.0 110.601 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 22' ' ' SER . 13.4 tpt180 -78.04 -23.39 48.16 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.782 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.71 35.68 0.59 Allowed Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.631 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.4 m-85 -125.15 170.5 11.16 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -1.115 . . . . 0.0 110.752 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.619 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.9 OUTLIER -76.01 -28.66 19.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-O 122.234 1.016 . . . . 0.0 108.298 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.576 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 175.99 -157.62 23.77 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.664 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.61 173.76 37.19 Favored Glycine 0 N--CA 1.488 2.111 0 C-N-CA 119.696 -1.24 . . . . 0.0 110.006 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.563 ' OD1' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -135.06 172.75 12.56 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.389 -1.065 . . . . 0.0 110.667 179.706 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.563 ' N ' ' OD1' ' A' ' 32' ' ' ASN . 56.2 m -127.79 115.69 19.04 Favored 'General case' 0 C--N 1.292 -1.891 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.221 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.526 ' O ' ' N ' ' A' ' 38' ' ' ARG . 0.7 OUTLIER -79.13 129.15 34.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.153 -0.967 . . . . 0.0 110.381 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -80.4 -32.58 34.12 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.39 -26.54 65.61 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.256 -1.143 . . . . 0.0 110.267 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.524 ' CG2' ' HB3' ' A' ' 34' ' ' LYS . 3.9 t -132.41 7.2 4.18 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.22 -0.925 . . . . 0.0 110.324 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.551 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 26.7 mtm180 40.65 55.43 2.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.478 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 1.8 m -116.69 162.06 18.25 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.256 -0.902 . . . . 0.0 110.205 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.69 ' O ' ' N ' ' A' ' 7' ' ' LYS . 7.9 t -100.04 124.56 45.54 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.877 . . . . 0.0 111.131 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.703 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.0 m-85 -107.09 166.38 10.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.159 -0.963 . . . . 0.0 109.322 178.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.751 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.01 119.37 12.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.671 -1.268 . . . . 0.0 111.012 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.653 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -83.41 138.48 33.47 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.796 0.808 . . . . 0.0 110.539 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.851 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.18 166.14 22.93 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.573 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.13 89.87 3.07 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.123 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.401 ' OXT' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.861 -176.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.435 0.636 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.89 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -154.89 158.64 39.63 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.348 -0.845 . . . . 0.0 111.106 178.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.665 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.7 m -130.33 138.06 50.24 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.656 0.741 . . . . 0.0 109.028 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.677 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -107.55 143.51 35.86 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 122.003 0.906 . . . . 0.0 111.209 -179.159 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.687 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -122.56 178.05 3.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.561 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -97.43 109.47 22.22 Favored 'General case' 0 C--N 1.296 -1.738 0 O-C-N 121.803 -0.561 . . . . 0.0 110.436 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -97.51 55.73 1.26 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.0 109.571 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.49 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -68.54 -20.28 64.54 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.434 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.49 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -75.47 0.96 59.01 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.7 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 41.2 m0 -102.8 -17.78 15.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -1.146 . . . . 0.0 110.336 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.14 140.77 8.41 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.547 ' O ' ' CD ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -43.7 162.51 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.422 -1.046 . . . . 0.0 110.447 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 34.5 t -108.6 148.0 30.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.275 -0.891 . . . . 0.0 110.396 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.546 ' CD1' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.88 -32.57 8.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.4 -0.813 . . . . 0.0 110.392 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.546 HD13 ' CD1' ' A' ' 14' ' ' LEU . 4.0 mm -109.18 -146.57 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.425 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 0.8 OUTLIER -117.59 -25.0 7.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 179.497 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.451 ' O ' ' C ' ' A' ' 18' ' ' THR . 2.4 m -103.28 -24.2 13.54 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.539 -0.726 . . . . 0.0 109.441 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.451 ' C ' ' O ' ' A' ' 17' ' ' THR . 24.8 m -40.41 -52.26 2.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 0.0 109.389 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 24.1 t -64.02 -50.49 68.27 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.289 -0.882 . . . . 0.0 109.136 178.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.496 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -46.21 -40.3 11.12 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.729 -0.607 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -53.11 -60.64 3.03 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.198 -0.939 . . . . 0.0 109.828 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.7 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -56.98 -37.19 71.25 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.416 -0.803 . . . . 0.0 110.088 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.563 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 57.8 m -59.47 -62.07 2.15 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 110.319 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 25.4 tttt -50.84 -60.63 2.87 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 109.626 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -46.66 -30.54 2.39 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.215 0.531 . . . . 0.0 110.551 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -79.11 -23.1 44.31 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.221 -0.925 . . . . 0.0 108.705 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.16 37.77 0.55 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.987 -1.645 . . . . 0.0 108.987 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.59 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.0 m-85 -122.61 168.62 11.94 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.348 -1.089 . . . . 0.0 110.601 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.609 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -78.51 -28.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-O 122.176 0.988 . . . . 0.0 108.603 179.141 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.583 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.04 -159.97 25.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.681 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.8 -172.1 27.64 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.784 -1.198 . . . . 0.0 110.117 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.558 ' CG ' ' N ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -152.5 179.33 8.68 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.382 -1.069 . . . . 0.0 110.578 179.959 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.558 ' N ' ' CG ' ' A' ' 32' ' ' ASN . 24.4 m -127.54 88.69 2.83 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.198 0.523 . . . . 0.0 109.819 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.49 ' O ' ' CB ' ' A' ' 39' ' ' THR . 0.5 OUTLIER -154.66 -133.38 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.24 -0.912 . . . . 0.0 110.471 -179.532 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.98 -84.51 1.6 Allowed Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.149 -1.581 . . . . 0.0 109.149 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.551 ' O ' ' CB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -100.42 -32.84 10.62 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.299 -1.118 . . . . 0.0 109.668 179.517 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.551 ' CB ' ' O ' ' A' ' 36' ' ' MET . 0.1 OUTLIER 163.77 -26.66 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.534 ' CG ' ' C ' ' A' ' 37' ' ' THR . 46.0 mtp180 -153.52 62.96 0.74 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.596 -0.69 . . . . 0.0 109.605 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.494 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 2.0 m -112.33 -159.48 0.68 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.338 -0.851 . . . . 0.0 110.233 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.699 ' O ' ' N ' ' A' ' 7' ' ' LYS . 8.3 t -139.12 114.21 9.48 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.352 -0.843 . . . . 0.0 110.454 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.687 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 14.6 m-85 -103.03 163.16 12.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.005 -1.06 . . . . 0.0 109.432 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.681 ' HA ' ' HA2' ' A' ' 31' ' ' GLY . 82.1 m -139.28 119.69 13.88 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.741 -1.224 . . . . 0.0 110.677 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.665 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -84.52 139.97 31.77 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.211 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.89 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.4 m -127.39 167.07 22.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 CA-C-O 121.256 0.551 . . . . 0.0 110.032 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.582 ' ND2' HD13 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.34 89.69 3.18 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.888 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.77 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.757 -176.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.412 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.374 0.606 . . . . 0.0 110.406 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.875 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -153.78 158.88 41.57 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 111.166 178.988 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.665 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.6 m -130.48 138.79 50.44 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.745 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -108.77 143.09 38.37 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 122.033 0.92 . . . . 0.0 111.319 -178.872 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.708 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -119.01 179.52 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.65 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.736 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.593 ' N ' HG13 ' A' ' 5' ' ' ILE . 1.3 mtmp? -102.17 104.51 15.1 Favored 'General case' 0 C--N 1.295 -1.804 0 O-C-N 121.706 -0.621 . . . . 0.0 110.399 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.709 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.3 mmpt? -91.13 56.37 3.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.989 -1.07 . . . . 0.0 109.434 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.499 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -65.73 -25.29 67.23 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.329 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.499 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -68.2 -6.96 49.6 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.719 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.4 m0 -95.8 -20.04 19.15 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.303 -1.116 . . . . 0.0 110.365 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.479 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.43 142.13 9.52 Favored Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.506 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -40.7 163.71 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.538 -0.978 . . . . 0.0 110.063 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 49.1 t -94.97 151.55 19.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 110.926 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.513 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -111.26 -31.5 7.05 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.476 -0.765 . . . . 0.0 109.965 179.494 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.513 HG12 ' HG ' ' A' ' 14' ' ' LEU . 6.2 mm -119.86 -145.65 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.513 -0.742 . . . . 0.0 110.075 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.444 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 40.0 m-20 -116.37 -21.22 9.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.234 -0.916 . . . . 0.0 109.577 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.463 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -109.58 -25.11 10.62 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.482 -0.761 . . . . 0.0 109.46 179.431 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.491 ' OG1' ' CG1' ' A' ' 15' ' ' ILE . 57.9 m -40.78 -56.78 2.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.478 -0.764 . . . . 0.0 109.309 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.603 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 14.1 t -58.45 -52.64 64.76 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.305 -0.872 . . . . 0.0 109.054 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.52 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.76 -42.81 26.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.715 -0.616 . . . . 0.0 110.609 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -52.71 -60.75 2.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.947 . . . . 0.0 109.733 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.719 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.5 m -53.02 -37.88 61.87 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.391 -0.818 . . . . 0.0 109.632 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.54 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 58.2 m -60.58 -60.43 3.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.46 -0.775 . . . . 0.0 110.449 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -49.69 -61.06 2.33 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.366 -0.834 . . . . 0.0 109.59 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -47.69 -31.42 4.66 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 121.313 0.577 . . . . 0.0 110.241 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -76.46 -21.56 55.73 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.252 -0.905 . . . . 0.0 108.654 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 119.93 38.99 0.67 Allowed Glycine 0 N--CA 1.483 1.803 0 N-CA-C 108.84 -1.704 . . . . 0.0 108.84 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.587 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 37.2 m-85 -124.75 168.32 13.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.381 -1.07 . . . . 0.0 110.78 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.608 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -77.44 -28.83 16.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-O 122.177 0.989 . . . . 0.0 108.443 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.581 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.39 -159.05 24.93 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.624 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.08 178.93 36.84 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.532 ' OD1' ' N ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -143.19 165.03 28.54 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.302 -1.117 . . . . 0.0 110.976 179.698 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.532 ' N ' ' OD1' ' A' ' 32' ' ' ASN . 26.8 m -109.18 112.63 24.9 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.57 ' O ' ' N ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -79.03 119.42 22.14 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.127 -0.983 . . . . 0.0 110.282 -179.237 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -77.55 -35.72 35.82 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.4 tmm? -60.53 -19.98 58.81 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.239 -1.153 . . . . 0.0 110.013 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.552 ' CG2' ' HB3' ' A' ' 34' ' ' LYS . 2.6 t -145.77 17.99 1.46 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.324 -0.86 . . . . 0.0 110.293 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.57 ' N ' ' O ' ' A' ' 34' ' ' LYS . 1.8 mtt85 35.49 58.91 0.83 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.439 -0.788 . . . . 0.0 110.15 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.1 m -123.47 162.57 22.6 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.319 -0.863 . . . . 0.0 110.635 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.709 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.8 t -98.85 127.34 44.75 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.422 -0.799 . . . . 0.0 110.928 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.708 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 12.1 m-85 -107.67 168.39 9.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 109.37 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.745 ' O ' ' HA ' ' A' ' 4' ' ' MET . 81.3 m -145.05 118.12 8.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.646 -1.284 . . . . 0.0 110.907 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.665 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -83.93 139.11 32.8 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.56 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.875 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.84 166.88 22.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 CA-C-O 121.157 0.503 . . . . 0.0 109.695 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.568 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.25 90.19 3.14 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 177.858 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.412 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.757 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.694 -176.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.488 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.8 ttp180 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.398 0.618 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.882 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -147.77 158.64 44.12 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.051 179.061 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.681 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.5 m -129.51 139.58 51.51 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 177.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.768 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 25.8 mtm -108.5 145.63 34.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 122.094 0.949 . . . . 0.0 111.715 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.673 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -121.14 179.8 2.12 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.541 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.594 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -104.25 110.83 23.19 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 110.355 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.666 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.7 mmpt? -99.89 54.82 0.93 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.114 -0.991 . . . . 0.0 109.616 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -62.57 -26.06 68.39 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.366 0.603 . . . . 0.0 110.13 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.61 -9.56 45.27 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.712 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.0 m0 -94.07 -22.48 18.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.257 -1.143 . . . . 0.0 110.344 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.22 141.15 9.2 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.52 ' CD ' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -38.73 161.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.627 -0.925 . . . . 0.0 110.392 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.41 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 13.1 t -102.32 154.39 19.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.243 -0.91 . . . . 0.0 110.623 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.548 ' HG ' HG13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.62 -31.13 8.61 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.471 -0.768 . . . . 0.0 110.113 179.79 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.548 HG13 ' HG ' ' A' ' 14' ' ' LEU . 1.8 mt -116.26 -143.66 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.437 -0.789 . . . . 0.0 110.418 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.414 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 17.9 m-20 -119.89 -15.1 8.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.48 ' O ' ' C ' ' A' ' 18' ' ' THR . 31.4 m -113.66 -29.94 6.96 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.715 -0.615 . . . . 0.0 109.778 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.504 HG21 ' CD2' ' A' ' 14' ' ' LEU . 21.9 m -40.44 -50.44 2.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.373 -0.829 . . . . 0.0 109.254 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.8 t -61.71 -45.57 93.37 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.861 0.838 . . . . 0.0 108.923 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.516 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -52.72 -41.83 64.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.753 -0.592 . . . . 0.0 110.789 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -50.85 -58.53 5.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.089 -1.007 . . . . 0.0 109.677 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.712 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 18.8 m -57.84 -36.97 73.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.456 -0.778 . . . . 0.0 109.746 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.549 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.5 m -61.57 -60.85 3.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.365 -0.834 . . . . 0.0 110.408 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.663 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 2.0 mmmt -50.64 -60.7 2.77 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.404 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.6 m-20 -47.03 -29.78 2.3 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.274 0.559 . . . . 0.0 110.482 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -79.14 -23.03 44.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.213 -0.93 . . . . 0.0 108.778 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.508 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.61 35.81 0.63 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.663 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.3 m-85 -123.94 169.49 11.56 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.297 -1.119 . . . . 0.0 110.799 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.6 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -77.77 -29.31 16.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.555 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.94 -156.69 19.3 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.667 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -159.78 -169.49 23.15 Favored Glycine 0 N--CA 1.487 2.094 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.546 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -141.41 174.92 10.09 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.277 -1.131 . . . . 0.0 111.003 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.532 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 60.8 m -134.72 98.52 4.07 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.474 ' O ' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -79.23 125.06 28.97 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.311 -0.868 . . . . 0.0 110.74 -178.973 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.45 ' O ' ' HD3' ' A' ' 38' ' ' ARG . . . -82.95 -34.17 22.09 Favored Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.97 -30.61 68.01 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -1.108 . . . . 0.0 109.858 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.464 ' OG1' ' HB3' ' A' ' 34' ' ' LYS . 2.0 p -117.59 -0.78 11.78 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.344 -0.848 . . . . 0.0 110.123 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.474 ' HA ' ' O ' ' A' ' 34' ' ' LYS . 15.5 mmt180 42.62 54.87 4.4 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.32 -0.862 . . . . 0.0 110.017 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.29 148.03 52.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.946 . . . . 0.0 110.675 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.666 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.5 t -92.38 126.05 37.29 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.5 -0.75 . . . . 0.0 110.667 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.673 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.5 m-85 -108.44 167.82 9.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.992 . . . . 0.0 109.228 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.768 ' O ' ' HA ' ' A' ' 4' ' ' MET . 79.8 m -140.78 120.49 13.39 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.693 -1.254 . . . . 0.0 111.18 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.681 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.1 OUTLIER -85.33 138.72 32.11 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.463 179.767 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.882 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.98 166.51 21.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.572 ' ND2' HD12 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.37 90.64 3.23 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 178.048 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.488 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.794 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.814 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.252 0.549 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.998 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -149.24 155.85 41.23 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 119.065 -1.054 . . . . 0.0 111.83 178.819 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.683 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.3 m -130.4 139.75 50.61 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.76 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 20.8 mtm -110.43 149.82 29.74 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 122.134 0.969 . . . . 0.0 111.842 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.704 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -126.56 179.51 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.668 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.601 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -101.44 108.5 20.11 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.699 -0.626 . . . . 0.0 110.34 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.723 ' N ' ' O ' ' A' ' 40' ' ' CYS . 2.0 mptp? -95.66 55.22 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.162 -0.961 . . . . 0.0 109.652 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.52 -32.43 73.88 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.313 0.578 . . . . 0.0 110.123 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -57.77 -15.15 18.06 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.697 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 35.9 m0 -90.64 -25.04 20.31 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.309 -1.112 . . . . 0.0 110.45 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 113.77 141.77 7.95 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.491 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -42.32 168.1 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.411 -1.052 . . . . 0.0 110.261 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.449 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 22.4 t -121.85 154.14 37.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.0 110.628 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.544 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -114.09 -29.43 6.99 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.507 -0.745 . . . . 0.0 110.428 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.544 HG12 ' HG ' ' A' ' 14' ' ' LEU . 1.7 mm -104.24 -145.63 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.421 -0.799 . . . . 0.0 110.623 -179.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -123.34 -26.4 4.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.567 -0.708 . . . . 0.0 109.485 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.485 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -102.04 -29.72 11.61 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.434 -0.791 . . . . 0.0 109.616 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 17' ' ' THR . 52.8 m -39.98 -45.87 1.97 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.424 -0.797 . . . . 0.0 109.357 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.9 t -73.05 -47.76 41.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.501 -0.749 . . . . 0.0 109.329 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.527 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.45 -43.53 62.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.573 -0.704 . . . . 0.0 110.787 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 m170 -49.69 -58.77 4.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.147 -0.971 . . . . 0.0 109.558 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.697 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 71.5 p -57.57 -37.75 73.68 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 0.0 109.86 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.559 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.4 m -60.77 -59.71 4.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.458 -0.776 . . . . 0.0 110.435 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.637 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 14.3 tttp -50.86 -60.35 3.16 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.313 -0.867 . . . . 0.0 109.632 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -45.95 -30.3 1.73 Allowed 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.281 0.562 . . . . 0.0 110.459 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.46 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 1.1 tpt180 -78.61 -24.09 45.56 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.224 -0.922 . . . . 0.0 108.718 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.553 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.62 40.23 0.44 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.784 -1.727 . . . . 0.0 108.784 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.637 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 27.8 m-85 -127.24 167.86 15.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.386 -1.067 . . . . 0.0 110.624 -179.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.578 HD11 ' ND2' ' A' ' 45' ' ' ASN . 0.8 OUTLIER -77.34 -28.88 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.124 0.964 . . . . 0.0 108.531 179.095 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.562 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.46 -156.84 20.1 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.637 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.49 -166.53 19.48 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.549 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -146.67 176.41 9.87 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.264 -1.139 . . . . 0.0 110.907 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 64.3 m -135.97 97.69 3.69 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.489 ' CG ' ' OG1' ' A' ' 37' ' ' THR . 4.4 tttt -79.51 130.44 35.39 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.131 -0.98 . . . . 0.0 110.436 -179.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.458 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -81.07 -57.22 2.87 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -11.96 20.64 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.194 -1.18 . . . . 0.0 110.05 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.489 ' OG1' ' CG ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -117.93 -14.03 10.04 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.346 -0.846 . . . . 0.0 110.093 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.458 ' HG2' ' O ' ' A' ' 35' ' ' GLY . 3.4 mtt180 43.74 55.22 5.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.037 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 37' ' ' THR . 2.1 m -139.15 147.38 41.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.933 . . . . 0.0 110.5 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.723 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.5 t -92.43 123.57 35.84 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.561 -0.712 . . . . 0.0 110.569 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.704 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.7 m-85 -103.66 163.49 12.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.955 -1.091 . . . . 0.0 109.313 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.76 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -138.23 121.09 16.5 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.686 -1.259 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.683 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -87.63 139.88 30.09 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 119.729 -0.788 . . . . 0.0 110.704 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.998 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.85 167.62 19.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.578 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 91.3 3.24 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.906 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.793 -176.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.39 0.614 . . . . 0.0 110.384 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.895 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.47 158.85 43.17 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.21 179.034 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.683 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.4 m -129.39 138.86 51.74 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 177.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.77 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.83 145.06 40.11 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 122.024 0.916 . . . . 0.0 111.404 -178.802 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.717 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -123.36 177.94 3.7 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.595 ' HG2' ' CZ ' ' A' ' 41' ' ' TYR . 56.6 mttt -98.65 109.07 21.89 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.795 -0.565 . . . . 0.0 110.161 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.705 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -96.4 55.58 1.49 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.169 -0.957 . . . . 0.0 109.743 179.68 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -66.24 -22.3 66.32 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.094 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.486 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -69.15 -10.01 61.42 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.695 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.9 m0 -93.95 -16.16 24.23 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.189 -1.183 . . . . 0.0 110.274 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.46 140.96 9.04 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.53 ' O ' ' CD ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -40.22 162.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.445 -1.032 . . . . 0.0 110.142 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.533 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 12.1 t -100.09 155.19 17.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.0 110.851 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.534 ' HG ' HG12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -113.61 -30.04 6.95 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.62 -0.675 . . . . 0.0 109.995 179.662 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.534 HG12 ' HG ' ' A' ' 14' ' ' LEU . 5.7 mm -120.63 -141.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.615 -0.678 . . . . 0.0 110.202 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.435 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 94.0 m-20 -124.73 -20.86 4.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.426 -0.796 . . . . 0.0 109.74 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.478 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.9 OUTLIER -107.61 -31.46 8.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.37 -0.831 . . . . 0.0 109.572 179.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.478 ' C ' ' O ' ' A' ' 17' ' ' THR . 85.0 m -40.77 -50.44 3.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.34 -0.85 . . . . 0.0 109.053 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.8 t -61.47 -50.6 72.11 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.812 0.815 . . . . 0.0 108.935 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.538 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.81 -38.67 35.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.803 -0.561 . . . . 0.0 110.512 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -55.01 -62.51 1.61 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.133 -0.979 . . . . 0.0 109.58 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.695 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -52.85 -39.24 62.39 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.423 -0.798 . . . . 0.0 109.851 179.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.546 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.6 m -57.98 -62.33 1.9 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.334 -0.854 . . . . 0.0 110.452 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.623 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 12.2 mtmt -51.13 -60.03 3.55 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.293 -0.879 . . . . 0.0 109.575 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -46.13 -30.34 1.89 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.258 0.552 . . . . 0.0 110.398 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.404 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 30.7 tpt180 -80.43 -22.81 40.79 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.25 -0.906 . . . . 0.0 108.962 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.56 42.67 0.31 Allowed Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.623 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 37.6 m-85 -130.32 169.54 15.32 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.268 -1.136 . . . . 0.0 110.778 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.572 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -80.01 -28.05 12.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 CA-C-O 122.206 1.003 . . . . 0.0 108.404 178.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.581 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.88 -159.86 25.89 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.759 -1.337 . . . . 0.0 109.759 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.63 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.04 -173.58 29.84 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.527 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -150.18 176.11 11.15 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.301 -1.117 . . . . 0.0 110.692 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 39' ' ' THR . 29.9 m -124.28 83.23 2.12 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-O 121.251 0.548 . . . . 0.0 110.012 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.489 ' O ' ' HB ' ' A' ' 39' ' ' THR . 13.5 tttm -154.24 173.57 15.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.221 -0.925 . . . . 0.0 110.43 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 137.31 -108.37 0.64 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.361 -1.496 . . . . 0.0 109.361 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.07 -16.61 11.59 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.281 -1.129 . . . . 0.0 109.797 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.493 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 5.2 t -163.97 59.17 0.16 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.453 -0.779 . . . . 0.0 109.675 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 37' ' ' THR . 10.5 mmt180 59.39 58.11 3.11 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.414 -0.804 . . . . 0.0 109.785 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.546 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 1.4 m -83.04 151.09 25.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.303 -0.873 . . . . 0.0 109.775 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.705 ' O ' ' N ' ' A' ' 7' ' ' LYS . 13.5 t -85.95 121.05 28.03 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.268 -0.895 . . . . 0.0 111.312 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.717 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.6 m-30 -105.37 168.82 8.82 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.139 -0.976 . . . . 0.0 109.164 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.77 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.0 m -144.42 119.32 9.95 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.775 -1.203 . . . . 0.0 110.74 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.683 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -86.59 138.72 31.46 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.696 0.76 . . . . 0.0 110.433 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.895 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.97 21.77 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 CA-C-O 121.177 0.513 . . . . 0.0 109.834 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.571 ' ND2' HD13 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.24 90.1 3.14 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 177.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.441 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.729 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.865 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.463 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.421 0.629 . . . . 0.0 110.382 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.883 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.46 158.71 42.99 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.82 . . . . 0.0 111.121 178.974 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.669 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 1.6 m -130.38 138.27 50.29 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.718 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 3.9 mtm -108.65 143.43 37.73 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.04 0.924 . . . . 0.0 111.275 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.725 ' O ' ' HA ' ' A' ' 41' ' ' TYR . 0.5 OUTLIER -122.38 179.87 2.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.616 ' CG ' ' CZ ' ' A' ' 41' ' ' TYR . 4.5 mttt -101.91 107.95 19.26 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 121.598 -0.688 . . . . 0.0 110.403 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.719 ' N ' ' O ' ' A' ' 40' ' ' CYS . 6.3 mmtm -94.74 55.4 1.89 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.079 -1.013 . . . . 0.0 109.625 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -64.26 -24.09 67.54 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.252 0.549 . . . . 0.0 110.174 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.24 -5.71 43.32 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 40.8 m0 -96.91 -19.9 18.5 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.191 -1.182 . . . . 0.0 110.451 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.492 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.78 142.02 10.1 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.537 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -39.02 161.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.592 -0.946 . . . . 0.0 110.311 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.424 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 37.5 t -100.99 151.74 21.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.277 -0.889 . . . . 0.0 110.77 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.493 HD21 HG23 ' A' ' 18' ' ' THR . 0.2 OUTLIER -104.98 -32.13 8.89 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.548 -0.72 . . . . 0.0 110.025 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.55 ' CD1' ' OG1' ' A' ' 18' ' ' THR . 4.3 mt -116.51 -157.79 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.501 -0.75 . . . . 0.0 110.224 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.499 ' H ' ' CG2' ' A' ' 15' ' ' ILE . 86.7 m-20 -106.39 -14.97 14.94 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.471 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -113.57 -26.55 8.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.681 -0.637 . . . . 0.0 109.782 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.55 ' OG1' ' CD1' ' A' ' 15' ' ' ILE . 24.8 m -40.16 -58.12 1.54 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.906 . . . . 0.0 109.244 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.632 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 13.3 t -53.74 -51.56 62.94 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.362 -0.836 . . . . 0.0 109.026 178.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.575 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.39 -42.78 22.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.843 -0.536 . . . . 0.0 110.866 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 50.2 m170 -53.88 -62.4 1.68 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.074 -1.016 . . . . 0.0 109.67 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.688 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 75.7 p -51.35 -38.95 55.86 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.764 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.566 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 62.4 m -58.81 -60.94 3.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.8 . . . . 0.0 110.443 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.618 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.03 -61.48 2.13 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.344 -0.847 . . . . 0.0 109.56 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -48.78 -29.94 5.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.265 0.555 . . . . 0.0 110.391 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.52 -20.86 49.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.199 -0.938 . . . . 0.0 108.762 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.64 40.63 0.52 Allowed Glycine 0 N--CA 1.484 1.877 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.618 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 20.5 m-85 -129.42 170.23 13.94 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.239 -1.153 . . . . 0.0 110.889 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.601 HG13 ' CG2' ' A' ' 2' ' ' THR . 0.8 OUTLIER -79.11 -28.59 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.98 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.581 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.0 -158.83 24.07 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.657 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.57 -165.07 16.65 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.876 -1.289 . . . . 0.0 109.876 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.551 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -151.54 177.04 10.73 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.297 -1.119 . . . . 0.0 110.932 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.531 ' N ' ' CG ' ' A' ' 32' ' ' ASN . 57.5 m -137.38 99.55 4.0 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.566 ' CB ' ' CG2' ' A' ' 37' ' ' THR . 0.7 OUTLIER -79.51 121.67 25.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.266 -0.896 . . . . 0.0 110.783 -179.0 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.526 ' O ' ' CZ ' ' A' ' 38' ' ' ARG . . . -76.37 -26.72 63.01 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.129 -1.588 . . . . 0.0 109.129 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 24.5 ttm -71.97 -27.95 63.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.27 -1.135 . . . . 0.0 109.802 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.566 ' CG2' ' CB ' ' A' ' 34' ' ' LYS . 11.8 t -122.78 1.88 9.41 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.36 -0.837 . . . . 0.0 110.108 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.526 ' CZ ' ' O ' ' A' ' 35' ' ' GLY . 23.0 mmt180 42.04 54.54 4.04 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.251 -0.906 . . . . 0.0 109.876 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.484 ' OG1' HG23 ' A' ' 37' ' ' THR . 1.2 m -129.43 166.42 19.63 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.236 -0.915 . . . . 0.0 110.564 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.719 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.6 t -107.51 125.39 51.22 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.489 -0.757 . . . . 0.0 110.593 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.725 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 6.2 m-85 -106.34 165.56 11.17 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.024 -1.047 . . . . 0.0 109.342 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.718 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.0 m -142.17 119.55 11.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.0 110.91 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.669 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 0.2 OUTLIER -83.99 138.36 33.15 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.288 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.883 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.91 167.72 19.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 CA-C-O 121.238 0.542 . . . . 0.0 109.891 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.564 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 90.23 3.19 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.899 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.463 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.786 -176.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.485 0.66 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.87 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -162.52 159.02 24.35 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.389 -0.82 . . . . 0.0 111.223 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.849 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.27 138.45 50.5 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.81 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.5 OUTLIER -111.17 146.56 36.65 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 122.139 0.971 . . . . 0.0 111.536 -178.778 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.792 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.77 179.73 2.62 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.662 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.792 ' H ' HD12 ' A' ' 5' ' ' ILE . 1.1 mppt? -101.45 108.42 20.0 Favored 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.572 -0.705 . . . . 0.0 110.44 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 10.8 mmtm -94.77 55.69 1.92 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.127 -0.983 . . . . 0.0 109.603 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -22.3 66.7 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.202 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.94 -6.44 52.24 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.735 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.94 -24.73 16.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.274 -1.133 . . . . 0.0 110.401 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.92 141.81 6.9 Favored Glycine 0 N--CA 1.487 2.077 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -41.09 164.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.489 -1.006 . . . . 0.0 110.372 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.6 t -111.07 151.93 27.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 0.0 110.685 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.774 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.27 -31.32 8.68 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.496 -0.753 . . . . 0.0 110.088 179.766 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.774 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.3 mm -117.19 -145.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.475 -0.765 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.598 ' H ' HG22 ' A' ' 15' ' ' ILE . 15.5 m-20 -119.38 -26.43 5.83 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.525 -0.734 . . . . 0.0 109.338 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.5 m -98.74 -32.33 11.44 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.503 -0.748 . . . . 0.0 109.559 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.66 HG21 HD21 ' A' ' 14' ' ' LEU . 94.1 m -40.62 -45.82 2.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.36 -0.838 . . . . 0.0 109.236 179.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.608 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 9.1 t -68.53 -48.01 65.44 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.773 0.797 . . . . 0.0 109.14 178.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.506 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -50.64 -36.81 37.23 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 110.49 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -54.58 -62.72 1.47 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.133 -0.979 . . . . 0.0 109.549 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.735 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.5 m -53.31 -39.66 64.19 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.446 -0.784 . . . . 0.0 109.717 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.56 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.1 m -57.59 -62.1 2.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 110.509 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 24.3 ttpt -49.55 -61.31 2.18 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.33 -0.856 . . . . 0.0 109.469 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -47.47 -29.6 2.83 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.2 0.524 . . . . 0.0 110.499 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -79.25 -20.88 47.08 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.176 -0.952 . . . . 0.0 108.756 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.16 37.79 0.68 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.792 ' CD2' HG12 ' A' ' 44' ' ' VAL . 11.2 m-85 -124.31 168.0 13.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.367 -1.078 . . . . 0.0 110.457 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.971 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -76.7 -28.79 17.65 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-O 122.21 1.005 . . . . 0.0 108.31 178.882 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.591 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 176.99 -159.1 25.32 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.68 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.18 -179.75 36.1 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.428 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 O-C-N 121.331 -1.1 . . . . 0.0 110.721 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 5.8 t . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 121.065 0.46 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.73 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-85 -105.83 167.2 9.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 109.548 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.81 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.3 m -143.59 119.51 10.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.706 -1.246 . . . . 0.0 110.891 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.971 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.04 140.81 30.73 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.732 0.777 . . . . 0.0 110.633 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.87 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -127.33 166.64 23.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.14 0.495 . . . . 0.0 109.84 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.578 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.5 t30 -76.27 89.95 3.15 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 177.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.424 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.779 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.742 -176.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.401 0.62 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.898 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -157.59 158.36 35.42 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.909 0.862 . . . . 0.0 111.329 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.831 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.8 m -131.06 139.17 49.87 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.781 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.6 OUTLIER -109.75 145.95 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 122.038 0.923 . . . . 0.0 111.409 -178.829 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.734 HG13 ' N ' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -122.27 179.02 2.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.938 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.734 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -98.02 108.44 21.14 Favored 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.462 -179.938 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -98.27 55.45 1.13 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.119 -0.988 . . . . 0.0 109.661 179.556 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.494 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -67.15 -26.75 66.81 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.319 0.58 . . . . 0.0 110.103 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.494 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -61.78 -12.67 36.06 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.693 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 36.8 m0 -91.98 -17.97 24.36 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.266 -1.138 . . . . 0.0 110.303 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.469 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 108.0 140.04 9.19 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -40.93 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.591 -0.946 . . . . 0.0 110.122 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.8 t -110.22 151.53 27.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.188 -0.945 . . . . 0.0 110.77 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.862 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.71 -31.25 8.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.571 -0.706 . . . . 0.0 109.965 179.666 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.862 HD11 HD12 ' A' ' 14' ' ' LEU . 4.0 mm -109.93 -143.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.568 -0.708 . . . . 0.0 110.127 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.553 ' H ' HG22 ' A' ' 15' ' ' ILE . 25.8 m-20 -125.69 -20.8 4.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.369 -0.832 . . . . 0.0 109.876 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.486 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.3 m -105.13 -30.18 9.9 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.34 -0.85 . . . . 0.0 109.752 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.49 ' OG1' ' HB ' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -39.74 -53.99 2.14 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.288 -0.882 . . . . 0.0 109.205 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.593 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.2 t -58.74 -51.53 69.57 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.358 -0.839 . . . . 0.0 109.072 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.539 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.39 -41.21 19.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.804 -0.56 . . . . 0.0 110.804 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -54.29 -61.71 2.13 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.103 -0.998 . . . . 0.0 109.766 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.693 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -53.74 -37.53 63.45 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.398 -0.814 . . . . 0.0 110.03 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.577 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 63.6 m -58.43 -61.88 2.26 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.341 -0.85 . . . . 0.0 110.635 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.646 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 6.0 mtpt -50.69 -60.68 2.8 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.305 -0.872 . . . . 0.0 109.6 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -47.16 -29.69 2.45 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.182 0.515 . . . . 0.0 110.472 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 26' ' ' ARG . 0.3 OUTLIER -79.6 -23.49 42.66 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.256 -0.903 . . . . 0.0 108.815 179.42 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.25 41.15 0.37 Allowed Glycine 0 N--CA 1.484 1.846 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.716 ' CD1' HG12 ' A' ' 44' ' ' VAL . 27.7 m-85 -129.44 169.2 15.23 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.276 -1.132 . . . . 0.0 110.592 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.969 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.99 -28.3 13.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 122.19 0.995 . . . . 0.0 108.371 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.91 -158.57 23.69 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.712 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.48 -162.22 12.25 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.487 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 O-C-N 121.305 -1.115 . . . . 0.0 111.01 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.922 0.391 . . . . 0.0 110.558 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.719 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.5 m-30 -99.45 163.16 12.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.001 -1.062 . . . . 0.0 109.649 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.781 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.7 m -140.09 119.09 12.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.816 -1.177 . . . . 0.0 110.763 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.969 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.68 139.91 32.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.537 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.898 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.46 166.79 22.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-O 121.207 0.527 . . . . 0.0 109.801 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.58 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.7 t30 -76.34 90.03 3.19 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 177.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.422 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.723 -176.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.42 0.629 . . . . 0.0 110.375 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.895 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.95 158.09 41.57 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.377 -0.827 . . . . 0.0 111.085 178.882 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.828 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.18 138.8 51.95 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.759 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 18.5 mtm -109.85 146.19 35.5 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.113 0.959 . . . . 0.0 111.484 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.747 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -124.28 179.53 2.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.708 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.747 ' H ' HD12 ' A' ' 5' ' ' ILE . 8.0 mttt -101.37 109.23 21.03 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 121.634 -0.666 . . . . 0.0 110.336 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.688 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -93.83 55.24 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.105 -0.997 . . . . 0.0 109.511 179.503 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.554 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.9 OUTLIER -65.49 -28.99 69.59 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.323 0.582 . . . . 0.0 110.173 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.554 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -63.14 -11.07 37.13 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 37.2 m0 -93.72 -19.38 21.13 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.257 -1.143 . . . . 0.0 110.247 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 105.69 141.35 10.54 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.462 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -38.61 154.89 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.575 -0.956 . . . . 0.0 110.087 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 31.7 t -94.27 150.06 20.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.144 -0.972 . . . . 0.0 110.58 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.85 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.46 -31.2 8.65 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.463 -0.773 . . . . 0.0 110.034 179.729 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.85 HD13 ' C ' ' A' ' 14' ' ' LEU . 2.4 mm -115.15 -155.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.494 -0.754 . . . . 0.0 110.321 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.664 ' H ' HG22 ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.35 -26.1 11.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.688 179.666 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.492 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.3 OUTLIER -104.0 -28.95 11.23 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.457 -0.777 . . . . 0.0 109.638 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.565 HG21 HD21 ' A' ' 14' ' ' LEU . 3.0 m -39.02 -55.4 1.58 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.376 -0.828 . . . . 0.0 109.358 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.588 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -58.19 -52.28 66.21 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.342 -0.849 . . . . 0.0 108.977 178.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.431 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.87 -42.25 47.32 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.704 -0.622 . . . . 0.0 110.441 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -51.42 -59.05 4.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 0.0 109.709 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.688 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -57.35 -37.42 72.56 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.369 -0.832 . . . . 0.0 109.966 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.545 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.9 m -59.83 -60.06 4.44 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.259 -0.901 . . . . 0.0 110.568 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' O ' ' N ' ' A' ' 27' ' ' GLY . 16.9 mtpt -51.46 -60.76 2.78 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.637 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -43.52 -29.81 0.51 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.147 0.498 . . . . 0.0 110.686 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.571 ' HG2' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -79.79 -28.44 40.28 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.217 -0.927 . . . . 0.0 108.703 179.39 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 129.75 37.57 0.36 Allowed Glycine 0 N--CA 1.484 1.865 0 N-CA-C 108.678 -1.769 . . . . 0.0 108.678 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.571 ' CE2' ' HG2' ' A' ' 26' ' ' ARG . 20.5 m-85 -121.48 168.11 12.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.334 -1.098 . . . . 0.0 110.697 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.935 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.83 -28.12 13.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-O 122.102 0.953 . . . . 0.0 108.564 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.585 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.66 -160.3 26.8 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.642 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -161.31 172.53 37.56 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.615 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.305 -1.341 0 O-C-N 121.081 -1.246 . . . . 0.0 111.053 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.688 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.3 t . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 121.111 0.481 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.702 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 8.6 m-85 -109.99 169.27 8.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.12 -0.987 . . . . 0.0 109.133 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.759 ' O ' ' HA ' ' A' ' 4' ' ' MET . 86.2 m -143.99 118.98 9.99 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.701 -1.249 . . . . 0.0 110.725 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.935 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.83 139.04 31.62 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.486 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.895 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.24 23.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.58 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.7 t30 -76.23 89.82 3.12 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.431 ' O ' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.766 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.789 -176.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.516 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.487 0.66 . . . . 0.0 110.462 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.899 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.65 159.02 43.21 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.396 -0.815 . . . . 0.0 110.882 178.778 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.788 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -129.41 138.5 51.52 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.405 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.785 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.2 OUTLIER -110.15 142.66 41.35 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-O 122.051 0.929 . . . . 0.0 111.248 -178.888 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.755 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -120.9 178.14 2.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.755 ' H ' HD12 ' A' ' 5' ' ' ILE . 8.7 mttp -98.96 108.78 21.55 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.794 -0.566 . . . . 0.0 110.075 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.702 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.7 OUTLIER -98.1 55.68 1.17 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.118 -0.989 . . . . 0.0 109.873 179.764 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -21.3 64.72 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.279 0.561 . . . . 0.0 110.071 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.54 -6.84 51.43 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.744 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.281 -1.129 . . . . 0.0 110.215 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 108.77 140.68 9.18 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.456 ' C ' ' CD ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -41.29 155.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.458 -1.025 . . . . 0.0 110.173 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.5 t -100.22 153.28 19.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.173 -0.955 . . . . 0.0 110.762 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.794 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -107.35 -31.41 8.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.562 -0.711 . . . . 0.0 109.985 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.794 HD11 HD12 ' A' ' 14' ' ' LEU . 2.9 mm -117.37 -150.8 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.487 -0.758 . . . . 0.0 110.274 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.62 ' H ' HG22 ' A' ' 15' ' ' ILE . 4.5 m-20 -113.44 -26.13 8.47 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.443 -0.785 . . . . 0.0 109.427 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.469 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -99.21 -29.76 12.65 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.5 -0.75 . . . . 0.0 109.487 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.654 HG21 HD21 ' A' ' 14' ' ' LEU . 90.0 m -40.38 -49.72 2.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.38 -0.825 . . . . 0.0 109.276 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -64.31 -50.53 67.45 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.345 -0.847 . . . . 0.0 109.073 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.512 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.81 -39.64 18.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.734 -0.604 . . . . 0.0 110.662 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -53.03 -61.34 2.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.212 -0.93 . . . . 0.0 109.677 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.744 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.8 m -55.84 -38.75 70.47 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.459 -0.776 . . . . 0.0 109.87 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.54 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.3 m -58.8 -61.86 2.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.331 -0.856 . . . . 0.0 110.313 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.5 OUTLIER -50.66 -61.17 2.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.386 -0.821 . . . . 0.0 109.628 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -51.16 -27.6 9.04 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.15 0.5 . . . . 0.0 110.502 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 22' ' ' SER . 1.4 tpt180 -78.52 -22.43 47.36 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.2 -0.938 . . . . 0.0 108.677 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.36 38.54 0.51 Allowed Glycine 0 N--CA 1.484 1.871 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.635 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.2 m-85 -128.56 170.9 12.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.258 -1.142 . . . . 0.0 110.641 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.992 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.87 -28.32 15.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 CA-C-O 122.199 1.0 . . . . 0.0 108.433 179.197 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.588 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.0 -157.74 22.97 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.719 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.54 -166.2 18.87 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.474 ' O ' ' HA ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.408 0 O-C-N 121.292 -1.122 . . . . 0.0 110.686 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.702 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.5 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.03 0.443 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.746 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.9 m-85 -108.5 166.65 10.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.009 -1.057 . . . . 0.0 109.515 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.785 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.16 120.15 12.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.774 -1.204 . . . . 0.0 110.713 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.992 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.68 137.61 32.71 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.462 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.899 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.97 166.47 22.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.177 0.513 . . . . 0.0 109.774 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.56 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.4 t30 -76.19 90.58 3.12 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.516 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.756 -176.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.52 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.413 0.625 . . . . 0.0 110.418 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.93 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -150.04 158.08 43.8 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.073 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.798 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -128.59 138.71 52.35 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.796 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.04 143.06 40.6 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 122.064 0.935 . . . . 0.0 111.569 -178.784 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.788 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -120.54 -179.85 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.795 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.788 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -103.06 110.59 22.57 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 121.744 -0.598 . . . . 0.0 110.418 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.644 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.3 OUTLIER -100.69 54.81 0.87 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.044 -1.035 . . . . 0.0 109.692 179.428 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -23.6 67.41 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.285 0.564 . . . . 0.0 110.058 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.96 -7.71 44.79 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CE3' ' OG ' ' A' ' 22' ' ' SER . 38.8 m0 -95.47 -19.52 19.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.252 -1.146 . . . . 0.0 110.295 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 106.93 140.86 9.87 Favored Glycine 0 N--CA 1.488 2.125 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.507 ' N ' ' CD ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -39.28 160.65 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.994 . . . . 0.0 110.282 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.1 t -103.05 152.82 20.92 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.242 -0.911 . . . . 0.0 110.597 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.771 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.61 -30.89 9.21 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 110.064 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.771 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.5 mm -116.77 -148.41 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.525 -0.734 . . . . 0.0 110.283 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.635 ' H ' HG22 ' A' ' 15' ' ' ILE . 8.9 m-20 -114.58 -25.81 8.17 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.465 -0.772 . . . . 0.0 109.396 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.49 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -101.92 -29.85 11.58 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.565 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.624 HG21 HD21 ' A' ' 14' ' ' LEU . 4.4 m -39.42 -53.4 2.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.385 -0.822 . . . . 0.0 109.294 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.575 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 5.5 t -60.24 -46.14 90.83 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.376 -0.827 . . . . 0.0 109.038 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.502 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.53 -39.52 64.73 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.689 -0.632 . . . . 0.0 110.362 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.56 -59.21 4.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.174 -0.954 . . . . 0.0 109.617 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.688 ' OG ' ' CE3' ' A' ' 10' ' ' TRP . 9.0 t -58.44 -36.66 73.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.432 -0.792 . . . . 0.0 110.033 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.545 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 70.0 m -61.35 -60.86 3.07 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.316 -0.865 . . . . 0.0 110.443 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.593 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -52.56 -59.61 4.24 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.411 -0.806 . . . . 0.0 109.808 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -44.17 -30.06 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.228 0.537 . . . . 0.0 110.504 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 3.1 ttm-85 -79.72 -28.85 40.51 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.163 -0.961 . . . . 0.0 108.798 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 132.07 39.21 0.24 Allowed Glycine 0 N--CA 1.483 1.825 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.593 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.1 m-85 -125.23 170.09 11.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.375 -1.074 . . . . 0.0 110.692 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.936 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -79.56 -28.47 13.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.117 0.96 . . . . 0.0 108.502 179.124 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.579 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.27 -158.59 24.22 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.678 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -160.77 172.48 37.11 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.612 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.382 0 O-C-N 121.181 -1.188 . . . . 0.0 110.879 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.644 ' O ' ' N ' ' A' ' 7' ' ' LYS . 3.1 t . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 121.009 0.433 . . . . 0.0 110.76 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.739 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.3 m-85 -107.62 168.87 8.95 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.067 -1.02 . . . . 0.0 108.714 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.796 ' O ' ' HA ' ' A' ' 4' ' ' MET . 78.1 m -141.0 119.69 12.48 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.703 -1.248 . . . . 0.0 111.053 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.936 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.34 136.6 33.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.745 0.783 . . . . 0.0 110.224 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.93 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.0 165.62 23.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.558 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.3 t30 -75.84 90.65 2.93 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 106.606 -1.627 . . . . 0.0 106.606 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.52 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.752 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.791 -176.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.482 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.403 0.621 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.846 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -158.03 159.66 36.61 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.339 -0.85 . . . . 0.0 111.308 179.129 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.791 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.4 m -129.07 139.28 52.08 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.794 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -110.13 146.36 35.61 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.012 0.911 . . . . 0.0 111.609 -178.621 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.781 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -121.99 179.59 2.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.781 ' H ' HD12 ' A' ' 5' ' ' ILE . 6.3 mttp -100.63 108.97 21.0 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.74 -0.6 . . . . 0.0 110.597 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.697 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -95.37 56.0 1.8 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.092 -1.005 . . . . 0.0 109.592 179.316 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -69.65 -18.66 63.6 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.4 179.989 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.475 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -77.93 -0.79 76.83 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.726 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 42.1 m0 -100.84 -15.47 17.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -1.169 . . . . 0.0 110.251 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.89 141.44 9.8 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.491 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -41.3 165.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.461 -1.023 . . . . 0.0 110.19 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.3 t -107.84 153.75 22.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.135 -0.978 . . . . 0.0 110.89 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.773 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -108.33 -30.74 8.17 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 121.556 0.693 . . . . 0.0 110.006 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.721 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.6 mm -119.52 -147.92 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.556 -0.715 . . . . 0.0 110.351 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.613 ' H ' HG22 ' A' ' 15' ' ' ILE . 21.1 m-20 -116.12 -25.6 7.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.43 -0.794 . . . . 0.0 109.372 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.64 -30.0 12.72 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.472 -0.767 . . . . 0.0 109.536 179.328 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.773 HG21 HD21 ' A' ' 14' ' ' LEU . 44.9 m -41.05 -54.59 2.77 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.339 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.621 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.0 t -60.23 -49.99 75.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.306 -0.871 . . . . 0.0 109.076 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.488 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.65 -41.55 43.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.739 -0.601 . . . . 0.0 110.715 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -51.51 -59.83 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.714 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.726 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.5 m -56.35 -37.48 70.07 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.405 -0.809 . . . . 0.0 109.817 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.542 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.0 m -59.32 -61.99 2.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.431 -0.793 . . . . 0.0 110.526 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 7.8 mtpt -50.25 -60.22 3.19 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.418 -0.801 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.05 -30.0 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.312 0.577 . . . . 0.0 110.139 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.41 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 36.8 tpt85 -78.58 -21.38 48.72 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.333 -0.855 . . . . 0.0 108.822 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 122.03 40.81 0.5 Allowed Glycine 0 N--CA 1.484 1.837 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.622 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.8 m-85 -128.81 169.53 14.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -1.083 . . . . 0.0 110.654 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.905 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -78.58 -28.82 14.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.566 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.43 -157.33 21.1 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.693 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.23 -165.86 17.93 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.47 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 O-C-N 121.185 -1.185 . . . . 0.0 110.953 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.697 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.9 t . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 121.073 0.463 . . . . 0.0 110.749 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.682 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 4.6 m-85 -110.17 167.1 10.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.1 -1.0 . . . . 0.0 109.352 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.794 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.9 m -141.6 119.34 11.78 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.648 -1.282 . . . . 0.0 110.834 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.905 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -86.21 139.96 30.57 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.793 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.846 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.53 166.89 22.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.181 0.515 . . . . 0.0 109.707 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.559 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.5 t30 -76.33 90.35 3.19 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 177.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.786 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.415 0.626 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.892 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -160.49 158.6 29.58 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.832 0.825 . . . . 0.0 111.222 178.922 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.809 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.32 138.38 51.54 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.455 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.786 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.9 OUTLIER -110.17 141.26 43.33 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-O 122.091 0.948 . . . . 0.0 111.272 -178.956 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.778 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -119.87 179.44 2.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.798 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.778 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -102.48 105.39 15.93 Favored 'General case' 0 C--N 1.294 -1.81 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.706 ' N ' ' O ' ' A' ' 40' ' ' CYS . 43.3 mmtt -92.05 56.47 2.87 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.968 -1.082 . . . . 0.0 109.561 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.7 OUTLIER -64.93 -24.88 67.66 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.169 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.475 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -67.24 -7.9 47.53 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.738 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.2 m0 -94.78 -17.27 22.3 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -1.165 . . . . 0.0 110.335 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.65 140.59 8.2 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.415 ' HD2' ' H ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -44.84 157.35 0.07 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.431 -1.041 . . . . 0.0 109.836 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 18.0 t -105.59 152.35 23.2 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.115 -0.99 . . . . 0.0 111.087 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 1.042 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -111.92 -30.59 7.22 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.553 0.692 . . . . 0.0 109.934 179.471 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 1.042 HD11 HD12 ' A' ' 14' ' ' LEU . 1.5 mm -107.2 -148.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.502 -0.749 . . . . 0.0 110.466 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.545 ' H ' HG22 ' A' ' 15' ' ' ILE . 2.9 m-20 -122.55 -25.24 4.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.383 -0.823 . . . . 0.0 109.677 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.482 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -103.07 -29.89 11.08 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.4 -0.812 . . . . 0.0 109.512 179.505 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.482 ' C ' ' O ' ' A' ' 17' ' ' THR . 18.4 m -40.59 -47.4 2.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.302 -0.874 . . . . 0.0 109.092 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.629 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.2 t -66.9 -50.33 62.78 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-O 121.793 0.806 . . . . 0.0 109.112 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.476 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -48.17 -39.83 22.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.704 -0.623 . . . . 0.0 110.519 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.407 ' C ' ' CD2' ' A' ' 21' ' ' HIS . 3.7 t-160 -54.37 -61.74 2.11 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.194 -0.942 . . . . 0.0 109.595 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.738 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.3 m -52.81 -39.16 62.14 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.371 -0.831 . . . . 0.0 109.74 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.53 ' SG ' ' HA3' ' A' ' 31' ' ' GLY . 57.7 m -57.6 -62.05 2.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.662 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLY . 9.5 mtpt -49.39 -61.02 2.33 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.383 -0.823 . . . . 0.0 109.278 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m-20 -45.79 -31.41 2.04 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.189 0.519 . . . . 0.0 110.347 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -20.65 48.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.265 -0.897 . . . . 0.0 108.814 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 120.21 40.85 0.57 Allowed Glycine 0 N--CA 1.484 1.856 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.626 ' CD1' HG12 ' A' ' 44' ' ' VAL . 34.8 m-85 -126.59 168.47 14.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.37 -1.077 . . . . 0.0 110.696 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.988 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.56 -28.44 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 CA-C-O 122.141 0.972 . . . . 0.0 108.553 179.196 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.603 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.99 -159.2 24.72 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.713 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.65 -162.52 12.61 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.443 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 O-C-N 121.235 -1.156 . . . . 0.0 110.893 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.706 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 121.122 0.486 . . . . 0.0 110.871 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.749 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 11.4 m-85 -106.86 169.94 8.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.116 -0.99 . . . . 0.0 109.395 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.786 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.5 m -146.6 119.02 8.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.645 -1.285 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.988 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -84.9 138.5 32.48 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.652 0.739 . . . . 0.0 110.364 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.892 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.73 166.68 22.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-O 121.136 0.493 . . . . 0.0 109.796 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.575 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.4 t30 -76.21 89.72 3.11 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.44 ' OXT' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.753 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.796 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.44 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.3 ttp180 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.365 0.602 . . . . 0.0 110.381 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.921 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -151.85 157.8 42.38 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.232 178.969 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.845 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.82 139.1 51.3 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.825 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.99 144.5 41.22 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-O 122.097 0.951 . . . . 0.0 111.589 -178.727 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.769 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.32 179.36 2.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.704 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.769 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -97.63 112.03 24.07 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.556 -0.715 . . . . 0.0 110.456 -179.918 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.665 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -94.3 54.69 1.9 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.075 -1.016 . . . . 0.0 109.699 179.606 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.45 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.1 OUTLIER -70.28 -26.73 63.94 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.36 0.6 . . . . 0.0 110.1 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.45 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -65.19 -9.84 44.13 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.731 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.06 -16.72 22.46 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.338 -1.095 . . . . 0.0 110.337 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.504 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 110.73 141.81 8.92 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.504 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -34.23 151.45 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.646 -0.914 . . . . 0.0 110.304 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 15' ' ' ILE . 17.9 t -95.69 152.19 18.68 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.302 -0.874 . . . . 0.0 110.706 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.985 ' O ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -115.05 -31.7 5.96 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.521 -0.737 . . . . 0.0 110.731 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.985 HD13 ' O ' ' A' ' 14' ' ' LEU . 3.4 mm -128.22 169.18 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.217 -0.927 . . . . 0.0 111.065 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -75.22 -21.21 58.81 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.444 -0.785 . . . . 0.0 110.453 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.471 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.1 OUTLIER -106.62 -39.97 5.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.197 -0.939 . . . . 0.0 109.643 179.781 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.618 HG21 HD11 ' A' ' 14' ' ' LEU . 99.0 m -41.24 -39.05 1.25 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.273 -0.892 . . . . 0.0 108.654 179.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.572 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 6.2 t -71.54 -49.35 41.56 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.476 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.95 -35.94 62.3 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.749 -0.594 . . . . 0.0 110.307 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -53.6 -61.84 2.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.253 -0.905 . . . . 0.0 109.328 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.731 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 14.5 m -54.94 -41.94 71.67 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.41 -0.806 . . . . 0.0 109.505 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.546 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.4 m -56.29 -61.87 2.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.319 -0.863 . . . . 0.0 110.413 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 15.8 mtmt -50.1 -61.12 2.34 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.418 -0.801 . . . . 0.0 109.629 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -47.35 -29.52 2.61 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.211 0.529 . . . . 0.0 110.504 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -22.05 45.15 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.216 -0.928 . . . . 0.0 108.846 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 123.32 37.88 0.58 Allowed Glycine 0 N--CA 1.484 1.886 0 N-CA-C 108.802 -1.719 . . . . 0.0 108.802 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.768 ' CD2' HG12 ' A' ' 44' ' ' VAL . 6.8 m-85 -123.74 169.69 11.26 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -1.076 . . . . 0.0 110.463 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.999 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -80.45 -28.08 11.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 CA-C-O 122.202 1.001 . . . . 0.0 108.343 178.88 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.576 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.93 -159.46 24.42 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.64 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.41 172.36 36.8 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.612 ' C ' ' OD1' ' A' ' 32' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 O-C-N 121.016 -1.285 . . . . 0.0 111.458 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.665 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.2 t . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 121.141 0.496 . . . . 0.0 111.053 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.692 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-30 -110.72 168.75 9.24 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 108.762 178.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.825 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -142.0 118.54 10.96 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.717 -1.239 . . . . 0.0 110.776 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.999 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.24 137.89 32.7 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.218 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.921 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.88 166.63 21.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.139 0.495 . . . . 0.0 109.799 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.588 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.5 t30 -76.26 89.76 3.14 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.774 -176.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.42 ' C ' ' OG1' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.458 0.647 . . . . 0.0 110.442 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.852 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -167.53 159.28 12.05 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.792 0.806 . . . . 0.0 111.231 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.837 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.42 139.09 50.61 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.777 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 46.4 mtm -108.01 143.75 36.27 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.12 0.962 . . . . 0.0 111.548 -178.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.77 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -118.49 179.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.645 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.77 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.15 107.92 19.46 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.656 -0.652 . . . . 0.0 110.365 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.69 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -95.11 55.7 1.83 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.128 -0.982 . . . . 0.0 109.523 179.408 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.37 -17.19 64.18 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.256 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.24 -4.3 78.65 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.743 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 40.4 m0 -97.55 -24.71 15.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.389 -1.065 . . . . 0.0 110.337 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.34 142.0 7.08 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -40.59 163.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.503 -0.998 . . . . 0.0 110.281 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 t -105.43 151.87 23.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.189 -0.945 . . . . 0.0 110.788 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.971 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -107.35 -31.57 8.13 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.468 -0.77 . . . . 0.0 109.972 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.702 HD13 ' C ' ' A' ' 14' ' ' LEU . 4.2 mm -120.87 -147.23 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.517 -0.739 . . . . 0.0 110.26 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.632 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.9 OUTLIER -114.38 -26.66 7.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.437 -0.79 . . . . 0.0 109.241 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.449 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.68 -30.97 12.15 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.487 -0.758 . . . . 0.0 109.577 179.534 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.971 HG21 HD21 ' A' ' 14' ' ' LEU . 25.8 m -40.83 -47.96 3.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.381 -0.824 . . . . 0.0 109.29 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.598 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.3 t -67.33 -48.59 67.1 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.376 -0.827 . . . . 0.0 109.117 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.502 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.53 -38.51 54.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.692 -0.63 . . . . 0.0 110.534 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.09 -59.98 3.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.165 -0.959 . . . . 0.0 109.622 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.743 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.8 m -57.58 -38.87 75.58 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.382 -0.824 . . . . 0.0 109.706 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.558 ' SG ' ' HA3' ' A' ' 31' ' ' GLY . 60.5 m -60.13 -61.6 2.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.638 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.96 -61.0 2.49 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.607 179.9 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -51.04 -27.94 9.11 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-O 121.175 0.512 . . . . 0.0 110.601 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 22' ' ' SER . 13.4 tpt180 -78.04 -23.39 48.16 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.782 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.71 35.68 0.59 Allowed Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.638 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.4 m-85 -125.15 170.5 11.16 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -1.115 . . . . 0.0 110.752 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.937 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.01 -28.66 19.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-O 122.234 1.016 . . . . 0.0 108.298 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 175.99 -157.62 23.77 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.71 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.61 173.76 37.19 Favored Glycine 0 N--CA 1.488 2.111 0 C-N-CA 119.696 -1.24 . . . . 0.0 110.006 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.406 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.304 -1.395 0 O-C-N 121.389 -1.065 . . . . 0.0 110.667 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.69 ' O ' ' N ' ' A' ' 7' ' ' LYS . 7.9 t . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 121.14 0.495 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.728 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.0 m-85 -107.09 166.38 10.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.159 -0.963 . . . . 0.0 109.322 178.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.777 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.01 119.37 12.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.671 -1.268 . . . . 0.0 111.012 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.937 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.41 138.48 33.47 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.796 0.808 . . . . 0.0 110.539 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.852 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.18 166.14 22.93 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.577 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.6 t30 -76.13 89.87 3.07 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.434 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.861 -176.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.435 0.636 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.898 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -154.89 158.64 39.63 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.348 -0.845 . . . . 0.0 111.106 178.932 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.846 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.33 138.06 50.24 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.656 0.741 . . . . 0.0 109.028 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.712 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -107.55 143.51 35.86 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 122.003 0.906 . . . . 0.0 111.209 -179.159 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.78 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -122.56 178.05 3.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.78 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -97.43 109.47 22.22 Favored 'General case' 0 C--N 1.296 -1.738 0 O-C-N 121.803 -0.561 . . . . 0.0 110.436 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -97.51 55.73 1.26 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.0 109.571 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.501 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -68.54 -20.28 64.54 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.434 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.501 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -75.47 0.96 59.01 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.7 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 41.2 m0 -102.8 -17.78 15.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -1.146 . . . . 0.0 110.336 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.14 140.77 8.41 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.547 ' CD ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -43.7 162.51 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.422 -1.046 . . . . 0.0 110.447 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.5 t -108.6 148.0 30.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.275 -0.891 . . . . 0.0 110.396 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.904 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.88 -32.57 8.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.4 -0.813 . . . . 0.0 110.392 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.904 HD11 HD12 ' A' ' 14' ' ' LEU . 4.0 mm -109.18 -146.57 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.611 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -117.59 -25.0 7.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 179.497 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.451 ' O ' ' C ' ' A' ' 18' ' ' THR . 2.4 m -103.28 -24.2 13.54 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.539 -0.726 . . . . 0.0 109.441 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.451 ' C ' ' O ' ' A' ' 17' ' ' THR . 24.8 m -40.41 -52.26 2.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 0.0 109.389 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 24.1 t -64.02 -50.49 68.27 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.289 -0.882 . . . . 0.0 109.136 178.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.454 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -46.21 -40.3 11.12 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.729 -0.607 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -53.11 -60.64 3.03 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.198 -0.939 . . . . 0.0 109.828 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.7 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -56.98 -37.19 71.25 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.416 -0.803 . . . . 0.0 110.088 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 57.8 m -59.47 -62.07 2.15 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 110.319 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 25.4 tttt -50.84 -60.63 2.87 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 109.626 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -46.66 -30.54 2.39 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.215 0.531 . . . . 0.0 110.551 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -79.11 -23.1 44.31 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.221 -0.925 . . . . 0.0 108.705 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.16 37.77 0.55 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.987 -1.645 . . . . 0.0 108.987 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.772 ' CD2' HG12 ' A' ' 44' ' ' VAL . 9.0 m-85 -122.61 168.62 11.94 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.348 -1.089 . . . . 0.0 110.601 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.935 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.51 -28.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-O 122.176 0.988 . . . . 0.0 108.603 179.141 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.602 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.04 -159.97 25.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.724 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.8 -172.1 27.64 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.784 -1.198 . . . . 0.0 110.117 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.501 ' O ' ' HA ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.382 -1.069 . . . . 0.0 110.578 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.699 ' O ' ' N ' ' A' ' 7' ' ' LYS . 8.3 t . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.992 0.425 . . . . 0.0 110.454 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.707 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 14.6 m-85 -103.03 163.16 12.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.005 -1.06 . . . . 0.0 109.432 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.724 ' HA ' ' HA2' ' A' ' 31' ' ' GLY . 82.1 m -139.28 119.69 13.88 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.741 -1.224 . . . . 0.0 110.677 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.935 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -84.52 139.97 31.77 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.211 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.898 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.4 m -127.39 167.07 22.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 CA-C-O 121.256 0.551 . . . . 0.0 110.032 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.578 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.6 t30 -76.34 89.69 3.18 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.421 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.77 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.757 -176.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.421 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.374 0.606 . . . . 0.0 110.406 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.894 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -153.78 158.88 41.57 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 111.166 178.988 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.828 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -130.48 138.79 50.44 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.777 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -108.77 143.09 38.37 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 122.033 0.92 . . . . 0.0 111.319 -178.872 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.798 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -119.01 179.52 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.65 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.736 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.798 ' H ' HD12 ' A' ' 5' ' ' ILE . 1.3 mtmp? -102.17 104.51 15.1 Favored 'General case' 0 C--N 1.295 -1.804 0 O-C-N 121.706 -0.621 . . . . 0.0 110.399 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.679 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.3 mmpt? -91.13 56.37 3.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.989 -1.07 . . . . 0.0 109.434 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.485 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -65.73 -25.29 67.23 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.329 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.485 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -68.2 -6.96 49.6 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.719 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.4 m0 -95.8 -20.04 19.15 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.303 -1.116 . . . . 0.0 110.365 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.479 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.43 142.13 9.52 Favored Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -40.7 163.71 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.538 -0.978 . . . . 0.0 110.063 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 t -94.97 151.55 19.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 110.926 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 1.046 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -111.26 -31.5 7.05 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.476 -0.765 . . . . 0.0 109.965 179.494 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.668 HG22 ' H ' ' A' ' 16' ' ' ASP . 6.2 mm -119.86 -145.65 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.513 -0.742 . . . . 0.0 110.075 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.668 ' H ' HG22 ' A' ' 15' ' ' ILE . 40.0 m-20 -116.37 -21.22 9.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.234 -0.916 . . . . 0.0 109.577 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.463 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -109.58 -25.11 10.62 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.482 -0.761 . . . . 0.0 109.46 179.431 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . 1.046 HG21 HD21 ' A' ' 14' ' ' LEU . 57.9 m -40.78 -56.78 2.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.478 -0.764 . . . . 0.0 109.309 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.603 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 14.1 t -58.45 -52.64 64.76 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.305 -0.872 . . . . 0.0 109.054 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.49 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.76 -42.81 26.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.715 -0.616 . . . . 0.0 110.609 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -52.71 -60.75 2.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.947 . . . . 0.0 109.733 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.719 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.5 m -53.02 -37.88 61.87 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.391 -0.818 . . . . 0.0 109.632 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.547 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 58.2 m -60.58 -60.43 3.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.46 -0.775 . . . . 0.0 110.449 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.571 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -49.69 -61.06 2.33 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.366 -0.834 . . . . 0.0 109.59 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -47.69 -31.42 4.66 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 121.313 0.577 . . . . 0.0 110.241 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -76.46 -21.56 55.73 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.252 -0.905 . . . . 0.0 108.654 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 119.93 38.99 0.67 Allowed Glycine 0 N--CA 1.483 1.803 0 N-CA-C 108.84 -1.704 . . . . 0.0 108.84 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.638 ' CD1' HG12 ' A' ' 44' ' ' VAL . 37.2 m-85 -124.75 168.32 13.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.381 -1.07 . . . . 0.0 110.78 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.955 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.44 -28.83 16.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-O 122.177 0.989 . . . . 0.0 108.443 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.6 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.39 -159.05 24.93 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.681 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.08 178.93 36.84 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 O-C-N 121.302 -1.117 . . . . 0.0 110.976 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.679 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.8 t . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.139 0.495 . . . . 0.0 110.928 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.725 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 12.1 m-85 -107.67 168.39 9.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 109.37 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.777 ' O ' ' HA ' ' A' ' 4' ' ' MET . 81.3 m -145.05 118.12 8.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.646 -1.284 . . . . 0.0 110.907 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.955 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.93 139.11 32.8 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.56 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.894 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.84 166.88 22.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 CA-C-O 121.157 0.503 . . . . 0.0 109.695 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.563 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.4 t30 -76.25 90.19 3.14 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 177.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.436 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.757 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.694 -176.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.8 ttp180 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.398 0.618 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.901 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -147.77 158.64 44.12 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.051 179.061 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.803 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -129.51 139.58 51.51 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 177.232 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.799 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 25.8 mtm -108.5 145.63 34.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 122.094 0.949 . . . . 0.0 111.715 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.771 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -121.14 179.8 2.12 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.541 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.771 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -104.25 110.83 23.19 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 110.355 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.666 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.7 mmpt? -99.89 54.82 0.93 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.114 -0.991 . . . . 0.0 109.616 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -62.57 -26.06 68.39 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.366 0.603 . . . . 0.0 110.13 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.61 -9.56 45.27 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.712 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.0 m0 -94.07 -22.48 18.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.257 -1.143 . . . . 0.0 110.344 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.22 141.15 9.2 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.521 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -38.73 161.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.627 -0.925 . . . . 0.0 110.392 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 13.1 t -102.32 154.39 19.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.243 -0.91 . . . . 0.0 110.623 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.956 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -106.62 -31.13 8.61 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.471 -0.768 . . . . 0.0 110.113 179.79 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.573 HG13 ' HG ' ' A' ' 14' ' ' LEU . 1.8 mt -116.26 -143.66 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.437 -0.789 . . . . 0.0 110.418 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.541 ' H ' HG22 ' A' ' 15' ' ' ILE . 17.9 m-20 -119.89 -15.1 8.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.501 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 31.4 m -113.66 -29.94 6.96 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.715 -0.615 . . . . 0.0 109.778 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.956 HG21 HD21 ' A' ' 14' ' ' LEU . 21.9 m -40.44 -50.44 2.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.373 -0.829 . . . . 0.0 109.254 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.8 t -61.71 -45.57 93.37 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.861 0.838 . . . . 0.0 108.923 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 17' ' ' THR . . . -52.72 -41.83 64.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.753 -0.592 . . . . 0.0 110.789 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -50.85 -58.53 5.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.089 -1.007 . . . . 0.0 109.677 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.712 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 18.8 m -57.84 -36.97 73.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.456 -0.778 . . . . 0.0 109.746 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.556 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.5 m -61.57 -60.85 3.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.365 -0.834 . . . . 0.0 110.408 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.657 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 2.0 mmmt -50.64 -60.7 2.77 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.404 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.6 m-20 -47.03 -29.78 2.3 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.274 0.559 . . . . 0.0 110.482 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -79.14 -23.03 44.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.213 -0.93 . . . . 0.0 108.778 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.61 35.81 0.63 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.657 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.3 m-85 -123.94 169.49 11.56 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.297 -1.119 . . . . 0.0 110.799 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.826 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.77 -29.31 16.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.57 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.94 -156.69 19.3 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.727 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -159.78 -169.49 23.15 Favored Glycine 0 N--CA 1.487 2.094 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.517 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.417 0 O-C-N 121.277 -1.131 . . . . 0.0 111.003 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.666 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.5 t . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.06 0.457 . . . . 0.0 110.667 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.697 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.5 m-85 -108.44 167.82 9.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.992 . . . . 0.0 109.228 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.799 ' O ' ' HA ' ' A' ' 4' ' ' MET . 79.8 m -140.78 120.49 13.39 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.693 -1.254 . . . . 0.0 111.18 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.826 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.1 OUTLIER -85.33 138.72 32.11 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.463 179.767 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.901 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.98 166.51 21.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.57 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.3 t30 -76.37 90.64 3.23 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 178.048 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.512 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.794 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.814 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.448 ' O ' ' HA ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.252 0.549 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.997 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -149.24 155.85 41.23 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 119.065 -1.054 . . . . 0.0 111.83 178.819 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.785 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.3 m -130.4 139.75 50.61 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.79 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 20.8 mtm -110.43 149.82 29.74 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 122.134 0.969 . . . . 0.0 111.842 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.764 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -126.56 179.51 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.668 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.764 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -101.44 108.5 20.11 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.699 -0.626 . . . . 0.0 110.34 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.723 ' N ' ' O ' ' A' ' 40' ' ' CYS . 2.0 mptp? -95.66 55.22 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.162 -0.961 . . . . 0.0 109.652 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.4 OUTLIER -63.52 -32.43 73.88 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.313 0.578 . . . . 0.0 110.123 179.832 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.4 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -57.77 -15.15 18.06 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.692 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 35.9 m0 -90.64 -25.04 20.31 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.309 -1.112 . . . . 0.0 110.45 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 113.77 141.77 7.95 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.491 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -42.32 168.1 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.411 -1.052 . . . . 0.0 110.261 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 18' ' ' THR . 22.4 t -121.85 154.14 37.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.0 110.628 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.992 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -114.09 -29.43 6.99 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.507 -0.745 . . . . 0.0 110.428 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.992 HD11 HD12 ' A' ' 14' ' ' LEU . 1.7 mm -104.24 -145.63 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.421 -0.799 . . . . 0.0 110.623 -179.44 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.553 ' H ' HG22 ' A' ' 15' ' ' ILE . 26.7 m-20 -123.34 -26.4 4.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.567 -0.708 . . . . 0.0 109.485 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.485 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -102.04 -29.72 11.61 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.434 -0.791 . . . . 0.0 109.616 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 17' ' ' THR . 52.8 m -39.98 -45.87 1.97 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.424 -0.797 . . . . 0.0 109.357 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.9 t -73.05 -47.76 41.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.501 -0.749 . . . . 0.0 109.329 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.492 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.45 -43.53 62.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.573 -0.704 . . . . 0.0 110.787 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -49.69 -58.77 4.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.147 -0.971 . . . . 0.0 109.558 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.692 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 71.5 p -57.57 -37.75 73.68 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 0.0 109.86 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.567 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.4 m -60.77 -59.71 4.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.458 -0.776 . . . . 0.0 110.435 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.63 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 14.3 tttp -50.86 -60.35 3.16 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.313 -0.867 . . . . 0.0 109.632 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -45.95 -30.3 1.73 Allowed 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.281 0.562 . . . . 0.0 110.459 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.468 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 1.1 tpt180 -78.61 -24.09 45.56 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.224 -0.922 . . . . 0.0 108.718 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.62 40.23 0.44 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.784 -1.727 . . . . 0.0 108.784 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.65 ' CD1' HG12 ' A' ' 44' ' ' VAL . 27.8 m-85 -127.24 167.86 15.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.386 -1.067 . . . . 0.0 110.624 -179.406 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.886 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.34 -28.88 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.124 0.964 . . . . 0.0 108.531 179.095 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.582 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.46 -156.84 20.1 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.704 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -160.49 -166.53 19.48 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.5 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.264 -1.139 . . . . 0.0 110.907 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.723 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.5 t . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.953 0.406 . . . . 0.0 110.569 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.732 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.7 m-85 -103.66 163.49 12.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.955 -1.091 . . . . 0.0 109.313 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.79 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -138.23 121.09 16.5 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.686 -1.259 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.886 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -87.63 139.88 30.09 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 119.729 -0.788 . . . . 0.0 110.704 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.997 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.85 167.62 19.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.566 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.6 t30 -76.33 91.3 3.24 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.793 -176.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.454 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.39 0.614 . . . . 0.0 110.384 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.905 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.47 158.85 43.17 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.21 179.034 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.802 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.4 m -129.39 138.86 51.74 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 177.357 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.802 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.83 145.06 40.11 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 122.024 0.916 . . . . 0.0 111.404 -178.802 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.788 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.36 177.94 3.7 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.788 ' H ' HD12 ' A' ' 5' ' ' ILE . 56.6 mttt -98.65 109.07 21.89 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.795 -0.565 . . . . 0.0 110.161 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.705 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -96.4 55.58 1.49 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.169 -0.957 . . . . 0.0 109.743 179.68 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -66.24 -22.3 66.32 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.094 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.481 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -69.15 -10.01 61.42 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.695 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.9 m0 -93.95 -16.16 24.23 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.189 -1.183 . . . . 0.0 110.274 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.46 140.96 9.04 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.53 ' CD ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -40.22 162.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.445 -1.032 . . . . 0.0 110.142 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.1 t -100.09 155.19 17.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.0 110.851 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.651 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -113.61 -30.04 6.95 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.62 -0.675 . . . . 0.0 109.995 179.662 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.602 HG22 ' H ' ' A' ' 16' ' ' ASP . 5.7 mm -120.63 -141.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.615 -0.678 . . . . 0.0 110.202 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.602 ' H ' HG22 ' A' ' 15' ' ' ILE . 94.0 m-20 -124.73 -20.86 4.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.426 -0.796 . . . . 0.0 109.74 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.478 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.9 OUTLIER -107.61 -31.46 8.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.37 -0.831 . . . . 0.0 109.572 179.617 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.651 HG21 HD21 ' A' ' 14' ' ' LEU . 85.0 m -40.77 -50.44 3.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.34 -0.85 . . . . 0.0 109.053 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.8 t -61.47 -50.6 72.11 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.812 0.815 . . . . 0.0 108.935 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.511 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.81 -38.67 35.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.803 -0.561 . . . . 0.0 110.512 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -55.01 -62.51 1.61 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.133 -0.979 . . . . 0.0 109.58 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.695 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -52.85 -39.24 62.39 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.423 -0.798 . . . . 0.0 109.851 179.379 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.553 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.6 m -57.98 -62.33 1.9 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.334 -0.854 . . . . 0.0 110.452 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.616 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 12.2 mtmt -51.13 -60.03 3.55 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.293 -0.879 . . . . 0.0 109.575 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -46.13 -30.34 1.89 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.258 0.552 . . . . 0.0 110.398 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.414 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 30.7 tpt180 -80.43 -22.81 40.79 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.25 -0.906 . . . . 0.0 108.962 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.56 42.67 0.31 Allowed Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.683 ' CD1' HG12 ' A' ' 44' ' ' VAL . 37.6 m-85 -130.32 169.54 15.32 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.268 -1.136 . . . . 0.0 110.778 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 1.001 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -80.01 -28.05 12.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 CA-C-O 122.206 1.003 . . . . 0.0 108.404 178.984 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.597 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.88 -159.86 25.89 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.759 -1.337 . . . . 0.0 109.759 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.663 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.04 -173.58 29.84 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.488 ' O ' ' HA ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.513 0 O-C-N 121.301 -1.117 . . . . 0.0 110.692 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.705 ' O ' ' N ' ' A' ' 7' ' ' LYS . 13.5 t . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 121.209 0.528 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.739 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.6 m-30 -105.37 168.82 8.82 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.139 -0.976 . . . . 0.0 109.164 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.802 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.0 m -144.42 119.32 9.95 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.775 -1.203 . . . . 0.0 110.74 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 1.001 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -86.59 138.72 31.46 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.696 0.76 . . . . 0.0 110.433 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.905 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.97 21.77 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 CA-C-O 121.177 0.513 . . . . 0.0 109.834 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.573 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.5 t30 -76.24 90.1 3.14 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 177.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.729 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.865 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.473 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.421 0.629 . . . . 0.0 110.382 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.901 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.46 158.71 42.99 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.82 . . . . 0.0 111.121 178.974 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.829 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -130.38 138.27 50.29 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.76 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 3.9 mtm -108.65 143.43 37.73 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.04 0.924 . . . . 0.0 111.275 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.765 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -122.38 179.87 2.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.765 ' H ' HD12 ' A' ' 5' ' ' ILE . 4.5 mttt -101.91 107.95 19.26 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 121.598 -0.688 . . . . 0.0 110.403 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.719 ' N ' ' O ' ' A' ' 40' ' ' CYS . 6.3 mmtm -94.74 55.4 1.89 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.079 -1.013 . . . . 0.0 109.625 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -64.26 -24.09 67.54 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.252 0.549 . . . . 0.0 110.174 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.24 -5.71 43.32 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.683 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 40.8 m0 -96.91 -19.9 18.5 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.191 -1.182 . . . . 0.0 110.451 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.492 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.78 142.02 10.1 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -39.02 161.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.592 -0.946 . . . . 0.0 110.311 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.5 t -100.99 151.74 21.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.277 -0.889 . . . . 0.0 110.77 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.824 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -104.98 -32.13 8.89 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.548 -0.72 . . . . 0.0 110.025 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.817 HG22 ' H ' ' A' ' 16' ' ' ASP . 4.3 mt -116.51 -157.79 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.501 -0.75 . . . . 0.0 110.224 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.817 ' H ' HG22 ' A' ' 15' ' ' ILE . 86.7 m-20 -106.39 -14.97 14.94 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.55 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -113.57 -26.55 8.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.681 -0.637 . . . . 0.0 109.782 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.824 HG21 HD21 ' A' ' 14' ' ' LEU . 24.8 m -40.16 -58.12 1.54 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.906 . . . . 0.0 109.244 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.632 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 13.3 t -53.74 -51.56 62.94 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.362 -0.836 . . . . 0.0 109.026 178.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 17' ' ' THR . . . -47.39 -42.78 22.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.843 -0.536 . . . . 0.0 110.866 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.404 ' NE2' ' HB ' ' A' ' 17' ' ' THR . 50.2 m170 -53.88 -62.4 1.68 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.074 -1.016 . . . . 0.0 109.67 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.683 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 75.7 p -51.35 -38.95 55.86 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.764 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.573 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 62.4 m -58.81 -60.94 3.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.8 . . . . 0.0 110.443 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.613 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.03 -61.48 2.13 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.344 -0.847 . . . . 0.0 109.56 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -48.78 -29.94 5.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.265 0.555 . . . . 0.0 110.391 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.52 -20.86 49.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.199 -0.938 . . . . 0.0 108.762 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.64 40.63 0.52 Allowed Glycine 0 N--CA 1.484 1.877 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.613 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 20.5 m-85 -129.42 170.23 13.94 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.239 -1.153 . . . . 0.0 110.889 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.991 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -79.11 -28.59 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.98 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.0 -158.83 24.07 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.714 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.57 -165.07 16.65 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.876 -1.289 . . . . 0.0 109.876 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.492 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.473 0 O-C-N 121.297 -1.119 . . . . 0.0 110.932 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.719 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.6 t . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 121.008 0.433 . . . . 0.0 110.593 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.75 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 6.2 m-85 -106.34 165.56 11.17 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.024 -1.047 . . . . 0.0 109.342 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.76 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.0 m -142.17 119.55 11.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.0 110.91 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.991 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.99 138.36 33.15 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.288 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.901 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.91 167.72 19.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 CA-C-O 121.238 0.542 . . . . 0.0 109.891 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.569 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.6 t30 -76.33 90.23 3.19 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.473 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.786 -176.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.485 0.66 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.87 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -162.52 159.02 24.35 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.389 -0.82 . . . . 0.0 111.223 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.849 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.27 138.45 50.5 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.81 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.5 OUTLIER -111.17 146.56 36.65 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 122.139 0.971 . . . . 0.0 111.536 -178.778 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.792 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.77 179.73 2.62 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.662 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.792 ' H ' HD12 ' A' ' 5' ' ' ILE . 1.1 mppt? -101.45 108.42 20.0 Favored 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.572 -0.705 . . . . 0.0 110.44 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 10.8 mmtm -94.77 55.69 1.92 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.127 -0.983 . . . . 0.0 109.603 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -22.3 66.7 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.202 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.94 -6.44 52.24 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.735 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.94 -24.73 16.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.274 -1.133 . . . . 0.0 110.401 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.92 141.81 6.9 Favored Glycine 0 N--CA 1.487 2.077 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.524 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.09 164.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.489 -1.006 . . . . 0.0 110.372 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 34.6 t -111.07 151.93 27.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 0.0 110.685 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.774 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.27 -31.32 8.68 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.496 -0.753 . . . . 0.0 110.088 179.766 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.774 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.3 mm -117.19 -145.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.475 -0.765 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.598 ' H ' HG22 ' A' ' 15' ' ' ILE . 15.5 m-20 -119.38 -26.43 5.83 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.525 -0.734 . . . . 0.0 109.338 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.5 m -98.74 -32.33 11.44 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.503 -0.748 . . . . 0.0 109.559 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.66 HG21 HD21 ' A' ' 14' ' ' LEU . 94.1 m -40.62 -45.82 2.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.36 -0.838 . . . . 0.0 109.236 179.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.608 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 9.1 t -68.53 -48.01 65.44 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.773 0.797 . . . . 0.0 109.14 178.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.506 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -50.64 -36.81 37.23 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 110.49 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -54.58 -62.72 1.47 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.133 -0.979 . . . . 0.0 109.549 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.735 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.5 m -53.31 -39.66 64.19 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.446 -0.784 . . . . 0.0 109.717 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.56 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.1 m -57.59 -62.1 2.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 110.509 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 24.3 ttpt -49.55 -61.31 2.18 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.33 -0.856 . . . . 0.0 109.469 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -47.47 -29.6 2.83 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.2 0.524 . . . . 0.0 110.499 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -79.25 -20.88 47.08 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.176 -0.952 . . . . 0.0 108.756 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.16 37.79 0.68 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.792 ' CD2' HG12 ' A' ' 44' ' ' VAL . 11.2 m-85 -124.31 168.0 13.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.367 -1.078 . . . . 0.0 110.457 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.971 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -76.7 -28.79 17.65 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-O 122.21 1.005 . . . . 0.0 108.31 178.882 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.591 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 176.99 -159.1 25.32 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.68 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.18 -179.75 36.1 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.558 ' OD1' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -140.39 172.86 12.13 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.331 -1.1 . . . . 0.0 110.721 179.585 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.558 ' N ' ' OD1' ' A' ' 32' ' ' ASN . 59.5 m -129.17 102.33 6.42 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -78.84 120.3 23.26 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.305 -0.872 . . . . 0.0 110.43 -179.152 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.474 ' O ' ' NE ' ' A' ' 38' ' ' ARG . . . -71.55 -36.67 62.43 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.333 -1.507 . . . . 0.0 109.333 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 43.3 ttm -52.35 -35.01 50.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.255 -1.144 . . . . 0.0 110.002 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.443 ' O ' ' C ' ' A' ' 38' ' ' ARG . 36.3 p -128.05 9.45 6.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.282 -0.886 . . . . 0.0 110.274 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 34' ' ' LYS . 11.2 mmt180 40.98 55.9 3.05 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.304 -0.873 . . . . 0.0 110.118 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.424 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 1.6 m -122.63 162.04 22.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.264 -0.897 . . . . 0.0 110.499 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 5.8 t -100.61 125.16 46.97 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.413 -0.804 . . . . 0.0 110.954 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.73 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-85 -105.83 167.2 9.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 109.548 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.81 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.3 m -143.59 119.51 10.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.706 -1.246 . . . . 0.0 110.891 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.971 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.04 140.81 30.73 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.732 0.777 . . . . 0.0 110.633 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.87 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -127.33 166.64 23.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.14 0.495 . . . . 0.0 109.84 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.578 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.5 t30 -76.27 89.95 3.15 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 177.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.424 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.779 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.742 -176.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.401 0.62 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.898 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -157.59 158.36 35.42 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.909 0.862 . . . . 0.0 111.329 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.831 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.8 m -131.06 139.17 49.87 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.781 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.6 OUTLIER -109.75 145.95 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 122.038 0.923 . . . . 0.0 111.409 -178.829 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.734 HG13 ' N ' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -122.27 179.02 2.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.938 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.734 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -98.02 108.44 21.14 Favored 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.462 -179.938 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -98.27 55.45 1.13 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.119 -0.988 . . . . 0.0 109.661 179.556 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.494 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -67.15 -26.75 66.81 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.319 0.58 . . . . 0.0 110.103 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.494 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -61.78 -12.67 36.06 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.693 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 36.8 m0 -91.98 -17.97 24.36 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.266 -1.138 . . . . 0.0 110.303 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.469 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 108.0 140.04 9.19 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -40.93 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.591 -0.946 . . . . 0.0 110.122 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 12.8 t -110.22 151.53 27.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.188 -0.945 . . . . 0.0 110.77 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.862 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.71 -31.25 8.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.571 -0.706 . . . . 0.0 109.965 179.666 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.862 HD11 HD12 ' A' ' 14' ' ' LEU . 4.0 mm -109.93 -143.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.568 -0.708 . . . . 0.0 110.127 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.553 ' H ' HG22 ' A' ' 15' ' ' ILE . 25.8 m-20 -125.69 -20.8 4.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.369 -0.832 . . . . 0.0 109.876 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.486 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.3 m -105.13 -30.18 9.9 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.34 -0.85 . . . . 0.0 109.752 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.49 ' OG1' ' HB ' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -39.74 -53.99 2.14 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.288 -0.882 . . . . 0.0 109.205 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.593 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.2 t -58.74 -51.53 69.57 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.358 -0.839 . . . . 0.0 109.072 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.539 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.39 -41.21 19.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.804 -0.56 . . . . 0.0 110.804 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -54.29 -61.71 2.13 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.103 -0.998 . . . . 0.0 109.766 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.693 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -53.74 -37.53 63.45 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.398 -0.814 . . . . 0.0 110.03 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.577 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 63.6 m -58.43 -61.88 2.26 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.341 -0.85 . . . . 0.0 110.635 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.646 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 6.0 mtpt -50.69 -60.68 2.8 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.305 -0.872 . . . . 0.0 109.6 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -47.16 -29.69 2.45 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.182 0.515 . . . . 0.0 110.472 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 26' ' ' ARG . 0.3 OUTLIER -79.6 -23.49 42.66 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.256 -0.903 . . . . 0.0 108.815 179.42 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.25 41.15 0.37 Allowed Glycine 0 N--CA 1.484 1.846 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.716 ' CD1' HG12 ' A' ' 44' ' ' VAL . 27.7 m-85 -129.44 169.2 15.23 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.276 -1.132 . . . . 0.0 110.592 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.969 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.99 -28.3 13.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 122.19 0.995 . . . . 0.0 108.371 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.91 -158.57 23.69 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.712 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.48 -162.22 12.25 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.527 ' CG ' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -153.36 176.64 11.77 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.305 -1.115 . . . . 0.0 111.01 -179.874 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.573 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 78.8 m -136.52 95.14 3.1 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.93 ' HB3' HG22 ' A' ' 37' ' ' THR . 1.4 mmtt -79.31 123.12 27.16 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.131 -0.981 . . . . 0.0 110.716 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.406 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -77.44 -34.81 39.05 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.0 mtt -60.84 -38.43 85.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.362 -1.081 . . . . 0.0 109.735 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.93 HG22 ' HB3' ' A' ' 34' ' ' LYS . 8.8 t -116.12 4.51 13.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.358 -0.839 . . . . 0.0 109.977 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 34' ' ' LYS . 2.9 mtp180 39.05 56.63 2.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.384 -0.822 . . . . 0.0 110.009 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.617 ' OG1' HG23 ' A' ' 37' ' ' THR . 0.2 OUTLIER -128.07 157.93 39.37 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.285 -0.885 . . . . 0.0 110.654 -179.741 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t -99.91 116.86 32.95 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.495 -0.753 . . . . 0.0 110.558 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.719 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.5 m-30 -99.45 163.16 12.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.001 -1.062 . . . . 0.0 109.649 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.781 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.7 m -140.09 119.09 12.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.816 -1.177 . . . . 0.0 110.763 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.969 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.68 139.91 32.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.537 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.898 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.46 166.79 22.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-O 121.207 0.527 . . . . 0.0 109.801 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.58 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.7 t30 -76.34 90.03 3.19 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 177.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.422 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.723 -176.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.42 0.629 . . . . 0.0 110.375 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.895 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.95 158.09 41.57 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.377 -0.827 . . . . 0.0 111.085 178.882 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.828 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.18 138.8 51.95 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.759 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 18.5 mtm -109.85 146.19 35.5 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.113 0.959 . . . . 0.0 111.484 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.747 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -124.28 179.53 2.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.708 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.747 ' H ' HD12 ' A' ' 5' ' ' ILE . 8.0 mttt -101.37 109.23 21.03 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 121.634 -0.666 . . . . 0.0 110.336 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.688 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -93.83 55.24 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.105 -0.997 . . . . 0.0 109.511 179.503 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.554 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.9 OUTLIER -65.49 -28.99 69.59 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.323 0.582 . . . . 0.0 110.173 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.554 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -63.14 -11.07 37.13 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 37.2 m0 -93.72 -19.38 21.13 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.257 -1.143 . . . . 0.0 110.247 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 105.69 141.35 10.54 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.462 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -38.61 154.89 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.575 -0.956 . . . . 0.0 110.087 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.43 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 31.7 t -94.27 150.06 20.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.144 -0.972 . . . . 0.0 110.58 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.85 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.46 -31.2 8.65 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.463 -0.773 . . . . 0.0 110.034 179.729 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.85 HD13 ' C ' ' A' ' 14' ' ' LEU . 2.4 mm -115.15 -155.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.494 -0.754 . . . . 0.0 110.321 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.664 ' H ' HG22 ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.35 -26.1 11.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.688 179.666 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.492 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.3 OUTLIER -104.0 -28.95 11.23 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.457 -0.777 . . . . 0.0 109.638 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.565 HG21 HD21 ' A' ' 14' ' ' LEU . 3.0 m -39.02 -55.4 1.58 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.376 -0.828 . . . . 0.0 109.358 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.588 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -58.19 -52.28 66.21 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.342 -0.849 . . . . 0.0 108.977 178.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.431 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.87 -42.25 47.32 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.704 -0.622 . . . . 0.0 110.441 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -51.42 -59.05 4.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 0.0 109.709 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.688 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -57.35 -37.42 72.56 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.369 -0.832 . . . . 0.0 109.966 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.545 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.9 m -59.83 -60.06 4.44 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.259 -0.901 . . . . 0.0 110.568 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' O ' ' N ' ' A' ' 27' ' ' GLY . 16.9 mtpt -51.46 -60.76 2.78 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.637 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -43.52 -29.81 0.51 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.147 0.498 . . . . 0.0 110.686 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.571 ' HG2' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -79.79 -28.44 40.28 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.217 -0.927 . . . . 0.0 108.703 179.39 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 129.75 37.57 0.36 Allowed Glycine 0 N--CA 1.484 1.865 0 N-CA-C 108.678 -1.769 . . . . 0.0 108.678 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.571 ' CE2' ' HG2' ' A' ' 26' ' ' ARG . 20.5 m-85 -121.48 168.11 12.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.334 -1.098 . . . . 0.0 110.697 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.935 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.83 -28.12 13.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-O 122.102 0.953 . . . . 0.0 108.564 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.585 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.66 -160.3 26.8 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.642 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -161.31 172.53 37.56 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.615 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -128.37 161.93 28.29 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.081 -1.246 . . . . 0.0 111.053 -179.871 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.518 ' SG ' ' HB3' ' A' ' 19' ' ' CYS . 70.1 m -122.71 98.94 6.14 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.522 ' O ' ' N ' ' A' ' 38' ' ' ARG . 11.7 mttt -79.58 118.96 21.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.21 -0.931 . . . . 0.0 110.701 -179.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -75.1 -36.69 45.3 Favored Glycine 0 N--CA 1.489 2.195 0 N-CA-C 108.967 -1.653 . . . . 0.0 108.967 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.1 ttp -66.2 -26.4 67.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.342 -1.093 . . . . 0.0 110.09 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.514 ' OG1' ' HB3' ' A' ' 34' ' ' LYS . 7.0 p -119.41 0.04 11.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.275 -0.891 . . . . 0.0 110.066 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 34' ' ' LYS . 33.9 mtt180 40.89 54.95 3.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.34 -0.85 . . . . 0.0 110.218 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' A' ' 37' ' ' THR . 2.2 m -135.18 151.56 50.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.402 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.688 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.3 t -97.01 129.74 44.43 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.358 -0.839 . . . . 0.0 110.84 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.702 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 8.6 m-85 -109.99 169.27 8.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.12 -0.987 . . . . 0.0 109.133 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.759 ' O ' ' HA ' ' A' ' 4' ' ' MET . 86.2 m -143.99 118.98 9.99 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.701 -1.249 . . . . 0.0 110.725 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.935 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.83 139.04 31.62 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.486 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.895 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.24 23.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.58 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.7 t30 -76.23 89.82 3.12 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.431 ' O ' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.766 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.789 -176.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.516 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.487 0.66 . . . . 0.0 110.462 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.899 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.65 159.02 43.21 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.396 -0.815 . . . . 0.0 110.882 178.778 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.788 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -129.41 138.5 51.52 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.405 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.785 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.2 OUTLIER -110.15 142.66 41.35 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-O 122.051 0.929 . . . . 0.0 111.248 -178.888 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.755 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -120.9 178.14 2.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.755 ' H ' HD12 ' A' ' 5' ' ' ILE . 8.7 mttp -98.96 108.78 21.55 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.794 -0.566 . . . . 0.0 110.075 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.702 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.7 OUTLIER -98.1 55.68 1.17 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.118 -0.989 . . . . 0.0 109.873 179.764 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -21.3 64.72 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.279 0.561 . . . . 0.0 110.071 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.54 -6.84 51.43 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.744 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.281 -1.129 . . . . 0.0 110.215 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 108.77 140.68 9.18 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.29 155.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.458 -1.025 . . . . 0.0 110.173 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.467 ' N ' ' O ' ' A' ' 38' ' ' ARG . 35.5 t -100.22 153.28 19.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.173 -0.955 . . . . 0.0 110.762 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.794 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -107.35 -31.41 8.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.562 -0.711 . . . . 0.0 109.985 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.794 HD11 HD12 ' A' ' 14' ' ' LEU . 2.9 mm -117.37 -150.8 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.487 -0.758 . . . . 0.0 110.274 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.62 ' H ' HG22 ' A' ' 15' ' ' ILE . 4.5 m-20 -113.44 -26.13 8.47 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.443 -0.785 . . . . 0.0 109.427 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.469 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -99.21 -29.76 12.65 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.5 -0.75 . . . . 0.0 109.487 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.654 HG21 HD21 ' A' ' 14' ' ' LEU . 90.0 m -40.38 -49.72 2.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.38 -0.825 . . . . 0.0 109.276 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -64.31 -50.53 67.45 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.345 -0.847 . . . . 0.0 109.073 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.512 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.81 -39.64 18.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.734 -0.604 . . . . 0.0 110.662 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -53.03 -61.34 2.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.212 -0.93 . . . . 0.0 109.677 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.744 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.8 m -55.84 -38.75 70.47 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.459 -0.776 . . . . 0.0 109.87 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.54 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.3 m -58.8 -61.86 2.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.331 -0.856 . . . . 0.0 110.313 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.5 OUTLIER -50.66 -61.17 2.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.386 -0.821 . . . . 0.0 109.628 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -51.16 -27.6 9.04 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.15 0.5 . . . . 0.0 110.502 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 22' ' ' SER . 1.4 tpt180 -78.52 -22.43 47.36 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.2 -0.938 . . . . 0.0 108.677 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.36 38.54 0.51 Allowed Glycine 0 N--CA 1.484 1.871 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.635 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.2 m-85 -128.56 170.9 12.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.258 -1.142 . . . . 0.0 110.641 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.992 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.87 -28.32 15.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 CA-C-O 122.199 1.0 . . . . 0.0 108.433 179.197 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.588 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.0 -157.74 22.97 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.719 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.54 -166.2 18.87 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.54 ' CG ' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -154.58 177.15 11.53 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.292 -1.122 . . . . 0.0 110.686 179.947 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.54 ' N ' ' CG ' ' A' ' 32' ' ' ASN . 60.9 m -138.22 119.65 14.85 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.293 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 38' ' ' ARG . 22.0 tttt -79.06 167.55 20.9 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.176 -0.952 . . . . 0.0 110.554 -179.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -108.83 -30.04 3.87 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.7 mtt -68.15 -23.6 64.9 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.226 -1.161 . . . . 0.0 110.027 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.42 ' O ' ' C ' ' A' ' 38' ' ' ARG . 0.7 OUTLIER -143.68 9.76 1.58 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.309 -0.869 . . . . 0.0 110.186 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.579 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 0.3 OUTLIER 41.46 53.65 3.7 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.33 -0.856 . . . . 0.0 110.164 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.745 HG22 ' H ' ' A' ' 40' ' ' CYS . 2.2 m -95.84 -168.83 1.83 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 110.335 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.745 ' H ' HG22 ' A' ' 39' ' ' THR . 2.5 t -133.25 123.49 25.64 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.394 -0.816 . . . . 0.0 110.544 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.746 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.9 m-85 -108.5 166.65 10.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.009 -1.057 . . . . 0.0 109.515 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.785 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.16 120.15 12.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.774 -1.204 . . . . 0.0 110.713 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.992 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.68 137.61 32.71 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.462 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.899 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.97 166.47 22.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.177 0.513 . . . . 0.0 109.774 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.56 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.4 t30 -76.19 90.58 3.12 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.516 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.756 -176.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.52 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.413 0.625 . . . . 0.0 110.418 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.93 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -150.04 158.08 43.8 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.073 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.798 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -128.59 138.71 52.35 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.796 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.04 143.06 40.6 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 122.064 0.935 . . . . 0.0 111.569 -178.784 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.788 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -120.54 -179.85 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.795 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.788 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -103.06 110.59 22.57 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 121.744 -0.598 . . . . 0.0 110.418 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.644 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.3 OUTLIER -100.69 54.81 0.87 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.044 -1.035 . . . . 0.0 109.692 179.428 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -23.6 67.41 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.285 0.564 . . . . 0.0 110.058 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.96 -7.71 44.79 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CE3' ' OG ' ' A' ' 22' ' ' SER . 38.8 m0 -95.47 -19.52 19.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.252 -1.146 . . . . 0.0 110.295 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 106.93 140.86 9.87 Favored Glycine 0 N--CA 1.488 2.125 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.507 ' N ' ' CD ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -39.28 160.65 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.994 . . . . 0.0 110.282 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 14.1 t -103.05 152.82 20.92 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.242 -0.911 . . . . 0.0 110.597 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.771 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.61 -30.89 9.21 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 110.064 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.771 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.5 mm -116.77 -148.41 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.525 -0.734 . . . . 0.0 110.283 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.635 ' H ' HG22 ' A' ' 15' ' ' ILE . 8.9 m-20 -114.58 -25.81 8.17 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.465 -0.772 . . . . 0.0 109.396 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.49 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -101.92 -29.85 11.58 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.565 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.624 HG21 HD21 ' A' ' 14' ' ' LEU . 4.4 m -39.42 -53.4 2.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.385 -0.822 . . . . 0.0 109.294 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.575 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 5.5 t -60.24 -46.14 90.83 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.376 -0.827 . . . . 0.0 109.038 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.502 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.53 -39.52 64.73 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.689 -0.632 . . . . 0.0 110.362 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.56 -59.21 4.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.174 -0.954 . . . . 0.0 109.617 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.688 ' OG ' ' CE3' ' A' ' 10' ' ' TRP . 9.0 t -58.44 -36.66 73.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.432 -0.792 . . . . 0.0 110.033 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.545 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 70.0 m -61.35 -60.86 3.07 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.316 -0.865 . . . . 0.0 110.443 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.593 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -52.56 -59.61 4.24 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.411 -0.806 . . . . 0.0 109.808 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -44.17 -30.06 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.228 0.537 . . . . 0.0 110.504 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 3.1 ttm-85 -79.72 -28.85 40.51 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.163 -0.961 . . . . 0.0 108.798 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 132.07 39.21 0.24 Allowed Glycine 0 N--CA 1.483 1.825 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.593 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.1 m-85 -125.23 170.09 11.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.375 -1.074 . . . . 0.0 110.692 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.936 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -79.56 -28.47 13.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.117 0.96 . . . . 0.0 108.502 179.124 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.579 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.27 -158.59 24.22 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.678 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -160.77 172.48 37.11 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.612 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -124.18 162.15 24.23 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.181 -1.188 . . . . 0.0 110.879 -179.855 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 78.3 m -122.84 96.51 5.05 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.486 ' HB3' ' OG1' ' A' ' 37' ' ' THR . 0.8 OUTLIER -79.4 130.26 35.25 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.209 -0.932 . . . . 0.0 110.614 -179.214 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.547 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -85.55 -40.87 7.57 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -33.74 75.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -1.136 . . . . 0.0 109.762 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.486 ' OG1' ' HB3' ' A' ' 34' ' ' LYS . 30.1 p -111.02 -1.2 16.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.368 -0.833 . . . . 0.0 110.051 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.547 ' HG2' ' O ' ' A' ' 35' ' ' GLY . 1.3 mtm-85 40.15 55.4 2.69 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.863 . . . . 0.0 110.055 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' A' ' 37' ' ' THR . 0.4 OUTLIER -133.07 153.61 51.34 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.26 -0.9 . . . . 0.0 110.409 -179.81 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.644 ' O ' ' N ' ' A' ' 7' ' ' LYS . 3.1 t -98.92 127.42 44.84 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.526 -0.733 . . . . 0.0 110.76 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.739 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.3 m-85 -107.62 168.87 8.95 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.067 -1.02 . . . . 0.0 108.714 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.796 ' O ' ' HA ' ' A' ' 4' ' ' MET . 78.1 m -141.0 119.69 12.48 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.703 -1.248 . . . . 0.0 111.053 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.936 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.34 136.6 33.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.745 0.783 . . . . 0.0 110.224 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.93 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.0 165.62 23.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.558 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.3 t30 -75.84 90.65 2.93 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 106.606 -1.627 . . . . 0.0 106.606 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.52 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.752 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.791 -176.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.482 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.403 0.621 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.846 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -158.03 159.66 36.61 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.339 -0.85 . . . . 0.0 111.308 179.129 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.791 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.4 m -129.07 139.28 52.08 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.794 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -110.13 146.36 35.61 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.012 0.911 . . . . 0.0 111.609 -178.621 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.781 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -121.99 179.59 2.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.781 ' H ' HD12 ' A' ' 5' ' ' ILE . 6.3 mttp -100.63 108.97 21.0 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.74 -0.6 . . . . 0.0 110.597 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.697 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -95.37 56.0 1.8 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.092 -1.005 . . . . 0.0 109.592 179.316 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -69.65 -18.66 63.6 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.4 179.989 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.475 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -77.93 -0.79 76.83 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.726 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 42.1 m0 -100.84 -15.47 17.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -1.169 . . . . 0.0 110.251 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.89 141.44 9.8 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.3 165.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.461 -1.023 . . . . 0.0 110.19 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 12.3 t -107.84 153.75 22.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.135 -0.978 . . . . 0.0 110.89 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.773 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -108.33 -30.74 8.17 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 121.556 0.693 . . . . 0.0 110.006 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.721 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.6 mm -119.52 -147.92 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.556 -0.715 . . . . 0.0 110.351 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.613 ' H ' HG22 ' A' ' 15' ' ' ILE . 21.1 m-20 -116.12 -25.6 7.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.43 -0.794 . . . . 0.0 109.372 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.64 -30.0 12.72 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.472 -0.767 . . . . 0.0 109.536 179.328 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.773 HG21 HD21 ' A' ' 14' ' ' LEU . 44.9 m -41.05 -54.59 2.77 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.339 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.621 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.0 t -60.23 -49.99 75.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.306 -0.871 . . . . 0.0 109.076 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.488 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.65 -41.55 43.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.739 -0.601 . . . . 0.0 110.715 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -51.51 -59.83 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.714 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.726 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.5 m -56.35 -37.48 70.07 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.405 -0.809 . . . . 0.0 109.817 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.542 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.0 m -59.32 -61.99 2.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.431 -0.793 . . . . 0.0 110.526 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 7.8 mtpt -50.25 -60.22 3.19 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.418 -0.801 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.05 -30.0 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.312 0.577 . . . . 0.0 110.139 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.41 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 36.8 tpt85 -78.58 -21.38 48.72 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.333 -0.855 . . . . 0.0 108.822 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 122.03 40.81 0.5 Allowed Glycine 0 N--CA 1.484 1.837 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.622 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.8 m-85 -128.81 169.53 14.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -1.083 . . . . 0.0 110.654 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.905 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -78.58 -28.82 14.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.566 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.43 -157.33 21.1 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.693 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.23 -165.86 17.93 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.523 ' CG ' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -151.7 175.74 12.08 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.185 -1.185 . . . . 0.0 110.953 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 39' ' ' THR . 60.0 m -138.11 116.25 11.76 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.489 ' O ' ' HA ' ' A' ' 38' ' ' ARG . 11.0 mmmm -78.94 178.82 7.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.171 -0.956 . . . . 0.0 110.511 -179.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.495 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -117.39 -51.89 0.34 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.9 mtt -53.97 -33.37 56.74 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.298 -1.119 . . . . 0.0 109.964 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.561 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.1 t -125.0 0.4 7.93 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.356 -0.84 . . . . 0.0 110.156 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.554 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 0.8 OUTLIER 41.13 54.82 3.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.296 -0.877 . . . . 0.0 110.251 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.68 HG22 ' H ' ' A' ' 40' ' ' CYS . 3.1 m -100.85 -176.32 3.14 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.881 . . . . 0.0 110.35 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.697 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.9 t -123.81 126.16 45.97 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.282 -0.886 . . . . 0.0 110.749 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.682 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 4.6 m-85 -110.17 167.1 10.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.1 -1.0 . . . . 0.0 109.352 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.794 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.9 m -141.6 119.34 11.78 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.648 -1.282 . . . . 0.0 110.834 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.905 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -86.21 139.96 30.57 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.793 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.846 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.53 166.89 22.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.181 0.515 . . . . 0.0 109.707 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.559 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.5 t30 -76.33 90.35 3.19 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 177.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.786 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.415 0.626 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.892 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -160.49 158.6 29.58 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.832 0.825 . . . . 0.0 111.222 178.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.809 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.32 138.38 51.54 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.786 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.9 OUTLIER -110.17 141.26 43.33 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-O 122.091 0.948 . . . . 0.0 111.272 -178.956 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.778 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -119.87 179.44 2.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.798 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.778 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -102.48 105.39 15.93 Favored 'General case' 0 C--N 1.294 -1.81 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.706 ' N ' ' O ' ' A' ' 40' ' ' CYS . 43.3 mmtt -92.05 56.47 2.87 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.968 -1.082 . . . . 0.0 109.561 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.7 OUTLIER -64.93 -24.88 67.66 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.169 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.475 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -67.24 -7.9 47.53 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.738 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.2 m0 -94.78 -17.27 22.3 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -1.165 . . . . 0.0 110.335 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.65 140.59 8.2 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.4 OUTLIER -44.84 157.35 0.07 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.431 -1.041 . . . . 0.0 109.836 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.47 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 18.0 t -105.59 152.35 23.2 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.115 -0.99 . . . . 0.0 111.087 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 1.042 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -111.92 -30.59 7.22 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.553 0.692 . . . . 0.0 109.934 179.471 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 1.042 HD11 HD12 ' A' ' 14' ' ' LEU . 1.5 mm -107.2 -148.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.502 -0.749 . . . . 0.0 110.466 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.545 ' H ' HG22 ' A' ' 15' ' ' ILE . 2.9 m-20 -122.55 -25.24 4.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.383 -0.823 . . . . 0.0 109.677 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.482 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -103.07 -29.89 11.08 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.4 -0.812 . . . . 0.0 109.512 179.505 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.482 ' C ' ' O ' ' A' ' 17' ' ' THR . 18.4 m -40.59 -47.4 2.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.302 -0.874 . . . . 0.0 109.092 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.629 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.2 t -66.9 -50.33 62.78 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-O 121.793 0.806 . . . . 0.0 109.112 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.476 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -48.17 -39.83 22.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.704 -0.623 . . . . 0.0 110.519 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.407 ' C ' ' CD2' ' A' ' 21' ' ' HIS . 3.7 t-160 -54.37 -61.74 2.11 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.194 -0.942 . . . . 0.0 109.595 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.738 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.3 m -52.81 -39.16 62.14 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.371 -0.831 . . . . 0.0 109.74 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.53 ' SG ' ' HA3' ' A' ' 31' ' ' GLY . 57.7 m -57.6 -62.05 2.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.662 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLY . 9.5 mtpt -49.39 -61.02 2.33 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.383 -0.823 . . . . 0.0 109.278 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m-20 -45.79 -31.41 2.04 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.189 0.519 . . . . 0.0 110.347 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -20.65 48.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.265 -0.897 . . . . 0.0 108.814 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 120.21 40.85 0.57 Allowed Glycine 0 N--CA 1.484 1.856 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.626 ' CD1' HG12 ' A' ' 44' ' ' VAL . 34.8 m-85 -126.59 168.47 14.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.37 -1.077 . . . . 0.0 110.696 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.988 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.56 -28.44 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 CA-C-O 122.141 0.972 . . . . 0.0 108.553 179.196 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.603 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.99 -159.2 24.72 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.713 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.65 -162.52 12.61 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.498 ' CG ' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -158.64 175.42 13.66 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.235 -1.156 . . . . 0.0 110.893 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 39' ' ' THR . 58.4 m -133.18 116.8 16.68 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.81 ' HB3' HG22 ' A' ' 37' ' ' THR . 2.0 mmtt -79.17 169.32 18.33 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.158 -0.964 . . . . 0.0 110.832 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.475 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -111.48 -49.22 0.66 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.199 -1.561 . . . . 0.0 109.199 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.1 mmt -63.22 -25.11 68.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.243 -1.151 . . . . 0.0 109.78 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.81 HG22 ' HB3' ' A' ' 34' ' ' LYS . 11.2 t -124.03 -6.11 7.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.415 -0.803 . . . . 0.0 110.087 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.548 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER 41.87 56.02 3.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 109.88 -179.99 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.511 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 10.5 m -115.12 172.41 7.08 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.364 -0.835 . . . . 0.0 110.322 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.706 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t -109.22 124.98 51.75 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.435 -0.791 . . . . 0.0 110.871 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.749 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 11.4 m-85 -106.86 169.94 8.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.116 -0.99 . . . . 0.0 109.395 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.786 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.5 m -146.6 119.02 8.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.645 -1.285 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.988 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -84.9 138.5 32.48 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.652 0.739 . . . . 0.0 110.364 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.892 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.73 166.68 22.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-O 121.136 0.493 . . . . 0.0 109.796 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.575 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.4 t30 -76.21 89.72 3.11 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.44 ' OXT' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.753 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.796 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.44 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.3 ttp180 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.365 0.602 . . . . 0.0 110.381 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.921 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -151.85 157.8 42.38 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.232 178.969 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.845 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.82 139.1 51.3 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.825 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.99 144.5 41.22 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-O 122.097 0.951 . . . . 0.0 111.589 -178.727 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.769 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.32 179.36 2.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.704 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.769 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -97.63 112.03 24.07 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.556 -0.715 . . . . 0.0 110.456 -179.918 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.665 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -94.3 54.69 1.9 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.075 -1.016 . . . . 0.0 109.699 179.606 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.45 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.1 OUTLIER -70.28 -26.73 63.94 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.36 0.6 . . . . 0.0 110.1 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.45 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -65.19 -9.84 44.13 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.731 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.06 -16.72 22.46 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.338 -1.095 . . . . 0.0 110.337 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.504 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 110.73 141.81 8.92 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.504 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -34.23 151.45 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.646 -0.914 . . . . 0.0 110.304 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 15' ' ' ILE . 17.9 t -95.69 152.19 18.68 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.302 -0.874 . . . . 0.0 110.706 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.985 ' O ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -115.05 -31.7 5.96 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.521 -0.737 . . . . 0.0 110.731 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.985 HD13 ' O ' ' A' ' 14' ' ' LEU . 3.4 mm -128.22 169.18 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.217 -0.927 . . . . 0.0 111.065 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.594 ' HA ' ' HB2' ' A' ' 33' ' ' CYS . 20.7 m-20 -75.22 -21.21 58.81 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.444 -0.785 . . . . 0.0 110.453 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.471 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.1 OUTLIER -106.62 -39.97 5.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.197 -0.939 . . . . 0.0 109.643 179.781 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.618 HG21 HD11 ' A' ' 14' ' ' LEU . 99.0 m -41.24 -39.05 1.25 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.273 -0.892 . . . . 0.0 108.654 179.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.572 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 6.2 t -71.54 -49.35 41.56 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.476 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.95 -35.94 62.3 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.749 -0.594 . . . . 0.0 110.307 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -53.6 -61.84 2.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.253 -0.905 . . . . 0.0 109.328 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.731 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 14.5 m -54.94 -41.94 71.67 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.41 -0.806 . . . . 0.0 109.505 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.546 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.4 m -56.29 -61.87 2.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.319 -0.863 . . . . 0.0 110.413 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 15.8 mtmt -50.1 -61.12 2.34 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.418 -0.801 . . . . 0.0 109.629 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -47.35 -29.52 2.61 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.211 0.529 . . . . 0.0 110.504 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -22.05 45.15 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.216 -0.928 . . . . 0.0 108.846 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 123.32 37.88 0.58 Allowed Glycine 0 N--CA 1.484 1.886 0 N-CA-C 108.802 -1.719 . . . . 0.0 108.802 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.768 ' CD2' HG12 ' A' ' 44' ' ' VAL . 6.8 m-85 -123.74 169.69 11.26 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -1.076 . . . . 0.0 110.463 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.999 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -80.45 -28.08 11.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 CA-C-O 122.202 1.001 . . . . 0.0 108.343 178.88 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.576 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.93 -159.46 24.42 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.64 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.41 172.36 36.8 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.612 ' C ' ' OD1' ' A' ' 32' ' ' ASN . 0.2 OUTLIER -129.68 162.82 27.47 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.016 -1.285 . . . . 0.0 111.458 -179.373 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.594 ' HB2' ' HA ' ' A' ' 16' ' ' ASP . 1.4 t -112.8 97.74 6.75 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.537 ' O ' ' CA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -79.71 117.51 20.67 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.055 -1.028 . . . . 0.0 110.495 -179.487 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.461 ' O ' ' C ' ' A' ' 36' ' ' MET . . . -76.06 -44.81 17.51 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.461 ' C ' ' O ' ' A' ' 35' ' ' GLY . 0.3 OUTLIER -40.85 -43.62 2.09 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.319 -1.107 . . . . 0.0 109.923 179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.478 HG23 ' OG1' ' A' ' 39' ' ' THR . 1.7 t -124.16 9.39 8.63 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.345 -0.847 . . . . 0.0 109.926 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.537 ' CA ' ' O ' ' A' ' 34' ' ' LYS . 0.9 OUTLIER 45.34 52.26 8.97 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.354 -0.841 . . . . 0.0 110.083 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.478 ' OG1' HG23 ' A' ' 37' ' ' THR . 1.3 m -119.19 151.1 38.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.257 -0.902 . . . . 0.0 110.375 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.665 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.2 t -93.76 132.69 37.9 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.469 -0.77 . . . . 0.0 111.053 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.692 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-30 -110.72 168.75 9.24 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 108.762 178.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.825 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -142.0 118.54 10.96 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.717 -1.239 . . . . 0.0 110.776 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.999 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.24 137.89 32.7 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.218 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.921 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.88 166.63 21.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.139 0.495 . . . . 0.0 109.799 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.588 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.5 t30 -76.26 89.76 3.14 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.774 -176.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.42 ' C ' ' OG1' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.458 0.647 . . . . 0.0 110.442 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.852 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -167.53 159.28 12.05 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.792 0.806 . . . . 0.0 111.231 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.837 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.42 139.09 50.61 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.777 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 46.4 mtm -108.01 143.75 36.27 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.12 0.962 . . . . 0.0 111.548 -178.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.77 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -118.49 179.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.645 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.77 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.15 107.92 19.46 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.656 -0.652 . . . . 0.0 110.365 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.69 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -95.11 55.7 1.83 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.128 -0.982 . . . . 0.0 109.523 179.408 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.37 -17.19 64.18 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.256 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.24 -4.3 78.65 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.743 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 40.4 m0 -97.55 -24.71 15.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.389 -1.065 . . . . 0.0 110.337 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.34 142.0 7.08 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.55 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -40.59 163.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.503 -0.998 . . . . 0.0 110.281 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 49.1 t -105.43 151.87 23.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.189 -0.945 . . . . 0.0 110.788 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.971 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -107.35 -31.57 8.13 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.468 -0.77 . . . . 0.0 109.972 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.702 HD13 ' C ' ' A' ' 14' ' ' LEU . 4.2 mm -120.87 -147.23 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.517 -0.739 . . . . 0.0 110.26 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.632 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.9 OUTLIER -114.38 -26.66 7.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.437 -0.79 . . . . 0.0 109.241 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.449 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.68 -30.97 12.15 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.487 -0.758 . . . . 0.0 109.577 179.534 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.971 HG21 HD21 ' A' ' 14' ' ' LEU . 25.8 m -40.83 -47.96 3.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.381 -0.824 . . . . 0.0 109.29 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.598 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.3 t -67.33 -48.59 67.1 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.376 -0.827 . . . . 0.0 109.117 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.502 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.53 -38.51 54.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.692 -0.63 . . . . 0.0 110.534 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.09 -59.98 3.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.165 -0.959 . . . . 0.0 109.622 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.743 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.8 m -57.58 -38.87 75.58 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.382 -0.824 . . . . 0.0 109.706 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.558 ' SG ' ' HA3' ' A' ' 31' ' ' GLY . 60.5 m -60.13 -61.6 2.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.638 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.96 -61.0 2.49 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.607 179.9 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -51.04 -27.94 9.11 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-O 121.175 0.512 . . . . 0.0 110.601 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 22' ' ' SER . 13.4 tpt180 -78.04 -23.39 48.16 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.782 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.71 35.68 0.59 Allowed Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.638 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.4 m-85 -125.15 170.5 11.16 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -1.115 . . . . 0.0 110.752 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.937 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.01 -28.66 19.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-O 122.234 1.016 . . . . 0.0 108.298 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 175.99 -157.62 23.77 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.71 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.61 173.76 37.19 Favored Glycine 0 N--CA 1.488 2.111 0 C-N-CA 119.696 -1.24 . . . . 0.0 110.006 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.563 ' OD1' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -135.06 172.75 12.56 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.389 -1.065 . . . . 0.0 110.667 179.706 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.563 ' N ' ' OD1' ' A' ' 32' ' ' ASN . 56.2 m -127.79 115.69 19.04 Favored 'General case' 0 C--N 1.292 -1.891 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.221 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.675 ' HB3' HG22 ' A' ' 37' ' ' THR . 0.7 OUTLIER -79.13 129.15 34.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.153 -0.967 . . . . 0.0 110.381 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -80.4 -32.58 34.12 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.39 -26.54 65.61 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.256 -1.143 . . . . 0.0 110.267 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.675 HG22 ' HB3' ' A' ' 34' ' ' LYS . 3.9 t -132.41 7.2 4.18 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.22 -0.925 . . . . 0.0 110.324 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.55 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 26.7 mtm180 40.65 55.43 2.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.523 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 1.8 m -116.69 162.06 18.25 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.256 -0.902 . . . . 0.0 110.205 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.69 ' O ' ' N ' ' A' ' 7' ' ' LYS . 7.9 t -100.04 124.56 45.54 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.877 . . . . 0.0 111.131 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.728 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.0 m-85 -107.09 166.38 10.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.159 -0.963 . . . . 0.0 109.322 178.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.777 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.01 119.37 12.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.671 -1.268 . . . . 0.0 111.012 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.937 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.41 138.48 33.47 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.796 0.808 . . . . 0.0 110.539 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.852 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.18 166.14 22.93 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.577 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.6 t30 -76.13 89.87 3.07 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.434 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.861 -176.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.435 0.636 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.898 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -154.89 158.64 39.63 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.348 -0.845 . . . . 0.0 111.106 178.932 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.846 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.33 138.06 50.24 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.656 0.741 . . . . 0.0 109.028 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.712 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -107.55 143.51 35.86 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 122.003 0.906 . . . . 0.0 111.209 -179.159 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.78 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -122.56 178.05 3.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.78 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -97.43 109.47 22.22 Favored 'General case' 0 C--N 1.296 -1.738 0 O-C-N 121.803 -0.561 . . . . 0.0 110.436 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -97.51 55.73 1.26 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.0 109.571 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.501 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -68.54 -20.28 64.54 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.434 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.501 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -75.47 0.96 59.01 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.7 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 41.2 m0 -102.8 -17.78 15.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -1.146 . . . . 0.0 110.336 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.14 140.77 8.41 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.547 ' CD ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -43.7 162.51 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.422 -1.046 . . . . 0.0 110.447 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 34.5 t -108.6 148.0 30.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.275 -0.891 . . . . 0.0 110.396 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.904 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.88 -32.57 8.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.4 -0.813 . . . . 0.0 110.392 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.904 HD11 HD12 ' A' ' 14' ' ' LEU . 4.0 mm -109.18 -146.57 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.611 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -117.59 -25.0 7.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 179.497 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.451 ' O ' ' C ' ' A' ' 18' ' ' THR . 2.4 m -103.28 -24.2 13.54 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.539 -0.726 . . . . 0.0 109.441 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.451 ' C ' ' O ' ' A' ' 17' ' ' THR . 24.8 m -40.41 -52.26 2.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 0.0 109.389 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 24.1 t -64.02 -50.49 68.27 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.289 -0.882 . . . . 0.0 109.136 178.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.454 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -46.21 -40.3 11.12 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.729 -0.607 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -53.11 -60.64 3.03 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.198 -0.939 . . . . 0.0 109.828 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.7 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -56.98 -37.19 71.25 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.416 -0.803 . . . . 0.0 110.088 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 57.8 m -59.47 -62.07 2.15 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 110.319 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 25.4 tttt -50.84 -60.63 2.87 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 109.626 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -46.66 -30.54 2.39 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.215 0.531 . . . . 0.0 110.551 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -79.11 -23.1 44.31 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.221 -0.925 . . . . 0.0 108.705 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.16 37.77 0.55 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.987 -1.645 . . . . 0.0 108.987 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.772 ' CD2' HG12 ' A' ' 44' ' ' VAL . 9.0 m-85 -122.61 168.62 11.94 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.348 -1.089 . . . . 0.0 110.601 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.935 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.51 -28.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-O 122.176 0.988 . . . . 0.0 108.603 179.141 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.602 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.04 -159.97 25.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.724 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.8 -172.1 27.64 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.784 -1.198 . . . . 0.0 110.117 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.558 ' CG ' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -152.5 179.33 8.68 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.382 -1.069 . . . . 0.0 110.578 179.959 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.558 ' N ' ' CG ' ' A' ' 32' ' ' ASN . 24.4 m -127.54 88.69 2.83 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.198 0.523 . . . . 0.0 109.819 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.544 ' HB2' HD22 ' A' ' 32' ' ' ASN . 0.5 OUTLIER -154.66 -133.38 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.24 -0.912 . . . . 0.0 110.471 -179.532 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.98 -84.51 1.6 Allowed Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.149 -1.581 . . . . 0.0 109.149 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.714 ' C ' HG22 ' A' ' 37' ' ' THR . 0.0 OUTLIER -100.42 -32.84 10.62 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.299 -1.118 . . . . 0.0 109.668 179.517 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.714 HG22 ' C ' ' A' ' 36' ' ' MET . 0.1 OUTLIER 163.77 -26.66 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.534 ' CG ' ' C ' ' A' ' 37' ' ' THR . 46.0 mtp180 -153.52 62.96 0.74 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.596 -0.69 . . . . 0.0 109.605 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.797 HG22 ' H ' ' A' ' 40' ' ' CYS . 2.0 m -112.33 -159.48 0.68 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.338 -0.851 . . . . 0.0 110.233 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.797 ' H ' HG22 ' A' ' 39' ' ' THR . 8.3 t -139.12 114.21 9.48 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.352 -0.843 . . . . 0.0 110.454 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.707 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 14.6 m-85 -103.03 163.16 12.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.005 -1.06 . . . . 0.0 109.432 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.724 ' HA ' ' HA2' ' A' ' 31' ' ' GLY . 82.1 m -139.28 119.69 13.88 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.741 -1.224 . . . . 0.0 110.677 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.935 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -84.52 139.97 31.77 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.211 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.898 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.4 m -127.39 167.07 22.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 CA-C-O 121.256 0.551 . . . . 0.0 110.032 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.578 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.6 t30 -76.34 89.69 3.18 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.421 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.77 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.757 -176.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.421 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.374 0.606 . . . . 0.0 110.406 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.894 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -153.78 158.88 41.57 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 111.166 178.988 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.828 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -130.48 138.79 50.44 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.777 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -108.77 143.09 38.37 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 122.033 0.92 . . . . 0.0 111.319 -178.872 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.798 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -119.01 179.52 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.65 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.736 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.798 ' H ' HD12 ' A' ' 5' ' ' ILE . 1.3 mtmp? -102.17 104.51 15.1 Favored 'General case' 0 C--N 1.295 -1.804 0 O-C-N 121.706 -0.621 . . . . 0.0 110.399 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.679 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.3 mmpt? -91.13 56.37 3.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.989 -1.07 . . . . 0.0 109.434 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.485 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -65.73 -25.29 67.23 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.329 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.485 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -68.2 -6.96 49.6 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.719 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.4 m0 -95.8 -20.04 19.15 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.303 -1.116 . . . . 0.0 110.365 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.479 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.43 142.13 9.52 Favored Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -40.7 163.71 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.538 -0.978 . . . . 0.0 110.063 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 49.1 t -94.97 151.55 19.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 110.926 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 1.046 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -111.26 -31.5 7.05 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.476 -0.765 . . . . 0.0 109.965 179.494 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.668 HG22 ' H ' ' A' ' 16' ' ' ASP . 6.2 mm -119.86 -145.65 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.513 -0.742 . . . . 0.0 110.075 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.668 ' H ' HG22 ' A' ' 15' ' ' ILE . 40.0 m-20 -116.37 -21.22 9.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.234 -0.916 . . . . 0.0 109.577 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.463 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -109.58 -25.11 10.62 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.482 -0.761 . . . . 0.0 109.46 179.431 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . 1.046 HG21 HD21 ' A' ' 14' ' ' LEU . 57.9 m -40.78 -56.78 2.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.478 -0.764 . . . . 0.0 109.309 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.603 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 14.1 t -58.45 -52.64 64.76 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.305 -0.872 . . . . 0.0 109.054 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.49 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.76 -42.81 26.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.715 -0.616 . . . . 0.0 110.609 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -52.71 -60.75 2.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.947 . . . . 0.0 109.733 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.719 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.5 m -53.02 -37.88 61.87 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.391 -0.818 . . . . 0.0 109.632 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.547 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 58.2 m -60.58 -60.43 3.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.46 -0.775 . . . . 0.0 110.449 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.571 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -49.69 -61.06 2.33 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.366 -0.834 . . . . 0.0 109.59 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -47.69 -31.42 4.66 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 121.313 0.577 . . . . 0.0 110.241 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -76.46 -21.56 55.73 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.252 -0.905 . . . . 0.0 108.654 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 119.93 38.99 0.67 Allowed Glycine 0 N--CA 1.483 1.803 0 N-CA-C 108.84 -1.704 . . . . 0.0 108.84 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.638 ' CD1' HG12 ' A' ' 44' ' ' VAL . 37.2 m-85 -124.75 168.32 13.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.381 -1.07 . . . . 0.0 110.78 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.955 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.44 -28.83 16.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-O 122.177 0.989 . . . . 0.0 108.443 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.6 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.39 -159.05 24.93 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.681 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.08 178.93 36.84 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.532 ' OD1' ' N ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -143.19 165.03 28.54 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.302 -1.117 . . . . 0.0 110.976 179.698 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.532 ' N ' ' OD1' ' A' ' 32' ' ' ASN . 26.8 m -109.18 112.63 24.9 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.154 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.57 ' O ' ' N ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -79.03 119.42 22.14 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.127 -0.983 . . . . 0.0 110.282 -179.237 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -77.55 -35.72 35.82 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.4 tmm? -60.53 -19.98 58.81 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.239 -1.153 . . . . 0.0 110.013 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.564 ' CG2' ' HB3' ' A' ' 34' ' ' LYS . 2.6 t -145.77 17.99 1.46 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.324 -0.86 . . . . 0.0 110.293 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.57 ' N ' ' O ' ' A' ' 34' ' ' LYS . 1.8 mtt85 35.49 58.91 0.83 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.439 -0.788 . . . . 0.0 110.15 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.1 m -123.47 162.57 22.6 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.319 -0.863 . . . . 0.0 110.635 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.679 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.8 t -98.85 127.34 44.75 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.422 -0.799 . . . . 0.0 110.928 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.725 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 12.1 m-85 -107.67 168.39 9.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 109.37 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.777 ' O ' ' HA ' ' A' ' 4' ' ' MET . 81.3 m -145.05 118.12 8.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.646 -1.284 . . . . 0.0 110.907 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.955 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.93 139.11 32.8 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.56 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.894 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.84 166.88 22.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 CA-C-O 121.157 0.503 . . . . 0.0 109.695 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.563 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.4 t30 -76.25 90.19 3.14 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 177.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.436 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.757 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.694 -176.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.8 ttp180 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.398 0.618 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.901 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -147.77 158.64 44.12 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.051 179.061 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.803 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -129.51 139.58 51.51 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 177.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.799 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 25.8 mtm -108.5 145.63 34.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 122.094 0.949 . . . . 0.0 111.715 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.771 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -121.14 179.8 2.12 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.541 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.771 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -104.25 110.83 23.19 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 110.355 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.666 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.7 mmpt? -99.89 54.82 0.93 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.114 -0.991 . . . . 0.0 109.616 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -62.57 -26.06 68.39 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.366 0.603 . . . . 0.0 110.13 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.61 -9.56 45.27 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.712 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.0 m0 -94.07 -22.48 18.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.257 -1.143 . . . . 0.0 110.344 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.22 141.15 9.2 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.521 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -38.73 161.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.627 -0.925 . . . . 0.0 110.392 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 13.1 t -102.32 154.39 19.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.243 -0.91 . . . . 0.0 110.623 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.956 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -106.62 -31.13 8.61 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.471 -0.768 . . . . 0.0 110.113 179.79 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.573 HG13 ' HG ' ' A' ' 14' ' ' LEU . 1.8 mt -116.26 -143.66 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.437 -0.789 . . . . 0.0 110.418 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.541 ' H ' HG22 ' A' ' 15' ' ' ILE . 17.9 m-20 -119.89 -15.1 8.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.501 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 31.4 m -113.66 -29.94 6.96 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.715 -0.615 . . . . 0.0 109.778 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.956 HG21 HD21 ' A' ' 14' ' ' LEU . 21.9 m -40.44 -50.44 2.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.373 -0.829 . . . . 0.0 109.254 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.8 t -61.71 -45.57 93.37 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.861 0.838 . . . . 0.0 108.923 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 17' ' ' THR . . . -52.72 -41.83 64.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.753 -0.592 . . . . 0.0 110.789 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -50.85 -58.53 5.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.089 -1.007 . . . . 0.0 109.677 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.712 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 18.8 m -57.84 -36.97 73.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.456 -0.778 . . . . 0.0 109.746 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.556 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.5 m -61.57 -60.85 3.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.365 -0.834 . . . . 0.0 110.408 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.657 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 2.0 mmmt -50.64 -60.7 2.77 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.404 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.6 m-20 -47.03 -29.78 2.3 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.274 0.559 . . . . 0.0 110.482 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -79.14 -23.03 44.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.213 -0.93 . . . . 0.0 108.778 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.61 35.81 0.63 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.657 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.3 m-85 -123.94 169.49 11.56 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.297 -1.119 . . . . 0.0 110.799 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.826 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.77 -29.31 16.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.57 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.94 -156.69 19.3 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.727 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -159.78 -169.49 23.15 Favored Glycine 0 N--CA 1.487 2.094 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.525 HD22 ' HD2' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -141.41 174.92 10.09 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.277 -1.131 . . . . 0.0 111.003 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.532 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 60.8 m -134.72 98.52 4.07 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 179.579 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.525 ' HD2' HD22 ' A' ' 32' ' ' ASN . 0.0 OUTLIER -79.23 125.06 28.97 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.311 -0.868 . . . . 0.0 110.74 -178.973 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.423 ' O ' ' HD3' ' A' ' 38' ' ' ARG . . . -82.95 -34.17 22.09 Favored Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.97 -30.61 68.01 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -1.108 . . . . 0.0 109.858 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.471 ' OG1' ' HB3' ' A' ' 34' ' ' LYS . 2.0 p -117.59 -0.78 11.78 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.344 -0.848 . . . . 0.0 110.123 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.468 ' HA ' ' O ' ' A' ' 34' ' ' LYS . 15.5 mmt180 42.62 54.87 4.4 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.32 -0.862 . . . . 0.0 110.017 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.29 148.03 52.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.946 . . . . 0.0 110.675 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.666 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.5 t -92.38 126.05 37.29 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.5 -0.75 . . . . 0.0 110.667 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.697 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.5 m-85 -108.44 167.82 9.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.992 . . . . 0.0 109.228 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.799 ' O ' ' HA ' ' A' ' 4' ' ' MET . 79.8 m -140.78 120.49 13.39 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.693 -1.254 . . . . 0.0 111.18 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.826 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.1 OUTLIER -85.33 138.72 32.11 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.463 179.767 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.901 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.98 166.51 21.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.57 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.3 t30 -76.37 90.64 3.23 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 178.048 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.512 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.794 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.814 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.448 ' O ' ' HA ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.252 0.549 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.997 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -149.24 155.85 41.23 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 119.065 -1.054 . . . . 0.0 111.83 178.819 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.785 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.3 m -130.4 139.75 50.61 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.79 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 20.8 mtm -110.43 149.82 29.74 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 122.134 0.969 . . . . 0.0 111.842 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.764 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -126.56 179.51 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.668 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.764 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -101.44 108.5 20.11 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.699 -0.626 . . . . 0.0 110.34 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.723 ' N ' ' O ' ' A' ' 40' ' ' CYS . 2.0 mptp? -95.66 55.22 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.162 -0.961 . . . . 0.0 109.652 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.4 OUTLIER -63.52 -32.43 73.88 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.313 0.578 . . . . 0.0 110.123 179.832 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.4 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -57.77 -15.15 18.06 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.692 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 35.9 m0 -90.64 -25.04 20.31 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.309 -1.112 . . . . 0.0 110.45 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 113.77 141.77 7.95 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.491 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -42.32 168.1 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.411 -1.052 . . . . 0.0 110.261 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 22.4 t -121.85 154.14 37.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.0 110.628 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.992 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -114.09 -29.43 6.99 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.507 -0.745 . . . . 0.0 110.428 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.992 HD11 HD12 ' A' ' 14' ' ' LEU . 1.7 mm -104.24 -145.63 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.421 -0.799 . . . . 0.0 110.623 -179.44 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.553 ' H ' HG22 ' A' ' 15' ' ' ILE . 26.7 m-20 -123.34 -26.4 4.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.567 -0.708 . . . . 0.0 109.485 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.485 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -102.04 -29.72 11.61 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.434 -0.791 . . . . 0.0 109.616 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 17' ' ' THR . 52.8 m -39.98 -45.87 1.97 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.424 -0.797 . . . . 0.0 109.357 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.9 t -73.05 -47.76 41.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.501 -0.749 . . . . 0.0 109.329 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.492 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.45 -43.53 62.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.573 -0.704 . . . . 0.0 110.787 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -49.69 -58.77 4.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.147 -0.971 . . . . 0.0 109.558 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.692 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 71.5 p -57.57 -37.75 73.68 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 0.0 109.86 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.567 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.4 m -60.77 -59.71 4.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.458 -0.776 . . . . 0.0 110.435 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.63 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 14.3 tttp -50.86 -60.35 3.16 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.313 -0.867 . . . . 0.0 109.632 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -45.95 -30.3 1.73 Allowed 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.281 0.562 . . . . 0.0 110.459 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.468 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 1.1 tpt180 -78.61 -24.09 45.56 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.224 -0.922 . . . . 0.0 108.718 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.62 40.23 0.44 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.784 -1.727 . . . . 0.0 108.784 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.65 ' CD1' HG12 ' A' ' 44' ' ' VAL . 27.8 m-85 -127.24 167.86 15.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.386 -1.067 . . . . 0.0 110.624 -179.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.886 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.34 -28.88 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.124 0.964 . . . . 0.0 108.531 179.095 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.582 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.46 -156.84 20.1 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.704 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -160.49 -166.53 19.48 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.507 ' CG ' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -146.67 176.41 9.87 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.264 -1.139 . . . . 0.0 110.907 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 64.3 m -135.97 97.69 3.69 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.489 ' CG ' ' OG1' ' A' ' 37' ' ' THR . 4.4 tttt -79.51 130.44 35.39 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.131 -0.98 . . . . 0.0 110.436 -179.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.478 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -81.07 -57.22 2.87 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -11.96 20.64 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.194 -1.18 . . . . 0.0 110.05 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.489 ' OG1' ' CG ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -117.93 -14.03 10.04 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.346 -0.846 . . . . 0.0 110.093 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 35' ' ' GLY . 3.4 mtt180 43.74 55.22 5.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.037 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 37' ' ' THR . 2.1 m -139.15 147.38 41.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.933 . . . . 0.0 110.5 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.723 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.5 t -92.43 123.57 35.84 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.561 -0.712 . . . . 0.0 110.569 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.732 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.7 m-85 -103.66 163.49 12.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.955 -1.091 . . . . 0.0 109.313 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.79 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -138.23 121.09 16.5 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.686 -1.259 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.886 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -87.63 139.88 30.09 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 119.729 -0.788 . . . . 0.0 110.704 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.997 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.85 167.62 19.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.566 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.6 t30 -76.33 91.3 3.24 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.793 -176.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.454 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.39 0.614 . . . . 0.0 110.384 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.905 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.47 158.85 43.17 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.21 179.034 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.802 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.4 m -129.39 138.86 51.74 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 177.357 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.802 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.83 145.06 40.11 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 122.024 0.916 . . . . 0.0 111.404 -178.802 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.788 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.36 177.94 3.7 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.788 ' H ' HD12 ' A' ' 5' ' ' ILE . 56.6 mttt -98.65 109.07 21.89 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.795 -0.565 . . . . 0.0 110.161 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.705 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -96.4 55.58 1.49 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.169 -0.957 . . . . 0.0 109.743 179.68 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -66.24 -22.3 66.32 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.094 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.481 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -69.15 -10.01 61.42 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.695 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.9 m0 -93.95 -16.16 24.23 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.189 -1.183 . . . . 0.0 110.274 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.46 140.96 9.04 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.53 ' CD ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -40.22 162.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.445 -1.032 . . . . 0.0 110.142 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' ARG . 12.1 t -100.09 155.19 17.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.0 110.851 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.651 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -113.61 -30.04 6.95 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.62 -0.675 . . . . 0.0 109.995 179.662 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.602 HG22 ' H ' ' A' ' 16' ' ' ASP . 5.7 mm -120.63 -141.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.615 -0.678 . . . . 0.0 110.202 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.602 ' H ' HG22 ' A' ' 15' ' ' ILE . 94.0 m-20 -124.73 -20.86 4.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.426 -0.796 . . . . 0.0 109.74 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.478 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.9 OUTLIER -107.61 -31.46 8.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.37 -0.831 . . . . 0.0 109.572 179.617 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.651 HG21 HD21 ' A' ' 14' ' ' LEU . 85.0 m -40.77 -50.44 3.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.34 -0.85 . . . . 0.0 109.053 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.8 t -61.47 -50.6 72.11 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.812 0.815 . . . . 0.0 108.935 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.511 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.81 -38.67 35.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.803 -0.561 . . . . 0.0 110.512 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -55.01 -62.51 1.61 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.133 -0.979 . . . . 0.0 109.58 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.695 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -52.85 -39.24 62.39 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.423 -0.798 . . . . 0.0 109.851 179.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.553 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.6 m -57.98 -62.33 1.9 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.334 -0.854 . . . . 0.0 110.452 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.616 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 12.2 mtmt -51.13 -60.03 3.55 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.293 -0.879 . . . . 0.0 109.575 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -46.13 -30.34 1.89 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.258 0.552 . . . . 0.0 110.398 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.414 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 30.7 tpt180 -80.43 -22.81 40.79 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.25 -0.906 . . . . 0.0 108.962 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.56 42.67 0.31 Allowed Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.683 ' CD1' HG12 ' A' ' 44' ' ' VAL . 37.6 m-85 -130.32 169.54 15.32 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.268 -1.136 . . . . 0.0 110.778 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 1.001 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -80.01 -28.05 12.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 CA-C-O 122.206 1.003 . . . . 0.0 108.404 178.984 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.597 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.88 -159.86 25.89 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.759 -1.337 . . . . 0.0 109.759 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.663 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.04 -173.58 29.84 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.634 HD22 ' HB2' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -150.18 176.11 11.15 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.301 -1.117 . . . . 0.0 110.692 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 39' ' ' THR . 29.9 m -124.28 83.23 2.12 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-O 121.251 0.548 . . . . 0.0 110.012 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.634 ' HB2' HD22 ' A' ' 32' ' ' ASN . 13.5 tttm -154.24 173.57 15.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.221 -0.925 . . . . 0.0 110.43 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 137.31 -108.37 0.64 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.361 -1.496 . . . . 0.0 109.361 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.07 -16.61 11.59 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.281 -1.129 . . . . 0.0 109.797 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 5.2 t -163.97 59.17 0.16 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.453 -0.779 . . . . 0.0 109.675 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 13' ' ' CYS . 10.5 mmt180 59.39 58.11 3.11 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.414 -0.804 . . . . 0.0 109.785 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.605 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 1.4 m -83.04 151.09 25.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.303 -0.873 . . . . 0.0 109.775 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.705 ' O ' ' N ' ' A' ' 7' ' ' LYS . 13.5 t -85.95 121.05 28.03 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.268 -0.895 . . . . 0.0 111.312 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.739 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.6 m-30 -105.37 168.82 8.82 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.139 -0.976 . . . . 0.0 109.164 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.802 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.0 m -144.42 119.32 9.95 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.775 -1.203 . . . . 0.0 110.74 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 1.001 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -86.59 138.72 31.46 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.696 0.76 . . . . 0.0 110.433 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.905 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.97 21.77 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 CA-C-O 121.177 0.513 . . . . 0.0 109.834 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.573 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.5 t30 -76.24 90.1 3.14 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 177.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.729 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.865 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.473 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.421 0.629 . . . . 0.0 110.382 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.901 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.46 158.71 42.99 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.82 . . . . 0.0 111.121 178.974 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.829 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -130.38 138.27 50.29 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.76 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 3.9 mtm -108.65 143.43 37.73 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.04 0.924 . . . . 0.0 111.275 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.765 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -122.38 179.87 2.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.765 ' H ' HD12 ' A' ' 5' ' ' ILE . 4.5 mttt -101.91 107.95 19.26 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 121.598 -0.688 . . . . 0.0 110.403 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.719 ' N ' ' O ' ' A' ' 40' ' ' CYS . 6.3 mmtm -94.74 55.4 1.89 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.079 -1.013 . . . . 0.0 109.625 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -64.26 -24.09 67.54 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.252 0.549 . . . . 0.0 110.174 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.24 -5.71 43.32 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.683 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 40.8 m0 -96.91 -19.9 18.5 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.191 -1.182 . . . . 0.0 110.451 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.492 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.78 142.02 10.1 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -39.02 161.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.592 -0.946 . . . . 0.0 110.311 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 37.5 t -100.99 151.74 21.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.277 -0.889 . . . . 0.0 110.77 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.824 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -104.98 -32.13 8.89 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.548 -0.72 . . . . 0.0 110.025 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.817 HG22 ' H ' ' A' ' 16' ' ' ASP . 4.3 mt -116.51 -157.79 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.501 -0.75 . . . . 0.0 110.224 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.817 ' H ' HG22 ' A' ' 15' ' ' ILE . 86.7 m-20 -106.39 -14.97 14.94 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.55 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -113.57 -26.55 8.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.681 -0.637 . . . . 0.0 109.782 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.824 HG21 HD21 ' A' ' 14' ' ' LEU . 24.8 m -40.16 -58.12 1.54 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.906 . . . . 0.0 109.244 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.632 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 13.3 t -53.74 -51.56 62.94 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.362 -0.836 . . . . 0.0 109.026 178.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 17' ' ' THR . . . -47.39 -42.78 22.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.843 -0.536 . . . . 0.0 110.866 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.404 ' NE2' ' HB ' ' A' ' 17' ' ' THR . 50.2 m170 -53.88 -62.4 1.68 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.074 -1.016 . . . . 0.0 109.67 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.683 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 75.7 p -51.35 -38.95 55.86 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.764 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.573 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 62.4 m -58.81 -60.94 3.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.8 . . . . 0.0 110.443 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.613 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.03 -61.48 2.13 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.344 -0.847 . . . . 0.0 109.56 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -48.78 -29.94 5.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.265 0.555 . . . . 0.0 110.391 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.52 -20.86 49.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.199 -0.938 . . . . 0.0 108.762 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.64 40.63 0.52 Allowed Glycine 0 N--CA 1.484 1.877 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.613 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 20.5 m-85 -129.42 170.23 13.94 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.239 -1.153 . . . . 0.0 110.889 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.991 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -79.11 -28.59 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.98 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.0 -158.83 24.07 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.714 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.57 -165.07 16.65 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.876 -1.289 . . . . 0.0 109.876 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.531 ' CG ' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -151.54 177.04 10.73 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.297 -1.119 . . . . 0.0 110.932 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.531 ' N ' ' CG ' ' A' ' 32' ' ' ASN . 57.5 m -137.38 99.55 4.0 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 1.012 ' HB3' HG22 ' A' ' 37' ' ' THR . 0.7 OUTLIER -79.51 121.67 25.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.266 -0.896 . . . . 0.0 110.783 -179.0 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.526 ' O ' ' CZ ' ' A' ' 38' ' ' ARG . . . -76.37 -26.72 63.01 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.129 -1.588 . . . . 0.0 109.129 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 24.5 ttm -71.97 -27.95 63.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.27 -1.135 . . . . 0.0 109.802 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 1.012 HG22 ' HB3' ' A' ' 34' ' ' LYS . 11.8 t -122.78 1.88 9.41 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.36 -0.837 . . . . 0.0 110.108 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.526 ' CZ ' ' O ' ' A' ' 35' ' ' GLY . 23.0 mmt180 42.04 54.54 4.04 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.251 -0.906 . . . . 0.0 109.876 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.492 ' OG1' HG23 ' A' ' 37' ' ' THR . 1.2 m -129.43 166.42 19.63 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.236 -0.915 . . . . 0.0 110.564 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.719 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.6 t -107.51 125.39 51.22 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.489 -0.757 . . . . 0.0 110.593 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.75 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 6.2 m-85 -106.34 165.56 11.17 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.024 -1.047 . . . . 0.0 109.342 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.76 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.0 m -142.17 119.55 11.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.0 110.91 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.991 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.99 138.36 33.15 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.288 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.901 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.91 167.72 19.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 CA-C-O 121.238 0.542 . . . . 0.0 109.891 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.569 ' OD1' HD11 ' A' ' 29' ' ' ILE . 2.6 t30 -76.33 90.23 3.19 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.473 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.786 -176.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.485 0.66 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.87 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -162.52 159.02 24.35 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.389 -0.82 . . . . 0.0 111.223 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.849 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.27 138.45 50.5 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.81 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.5 OUTLIER -111.17 146.56 36.65 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 122.139 0.971 . . . . 0.0 111.536 -178.778 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.792 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.77 179.73 2.62 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.662 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.792 ' H ' HD12 ' A' ' 5' ' ' ILE . 1.1 mppt? -101.45 108.42 20.0 Favored 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.572 -0.705 . . . . 0.0 110.44 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 10.8 mmtm -94.77 55.69 1.92 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.127 -0.983 . . . . 0.0 109.603 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -22.3 66.7 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.202 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.94 -6.44 52.24 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.735 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.94 -24.73 16.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.274 -1.133 . . . . 0.0 110.401 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.92 141.81 6.9 Favored Glycine 0 N--CA 1.487 2.077 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -41.09 164.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.489 -1.006 . . . . 0.0 110.372 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.6 t -111.07 151.93 27.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 0.0 110.685 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.774 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.27 -31.32 8.68 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.496 -0.753 . . . . 0.0 110.088 179.766 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.774 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.3 mm -117.19 -145.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.475 -0.765 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.598 ' H ' HG22 ' A' ' 15' ' ' ILE . 15.5 m-20 -119.38 -26.43 5.83 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.525 -0.734 . . . . 0.0 109.338 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.5 m -98.74 -32.33 11.44 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.503 -0.748 . . . . 0.0 109.559 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.66 HG21 HD21 ' A' ' 14' ' ' LEU . 94.1 m -40.62 -45.82 2.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.36 -0.838 . . . . 0.0 109.236 179.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.608 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 9.1 t -68.53 -48.01 65.44 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.773 0.797 . . . . 0.0 109.14 178.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.506 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -50.64 -36.81 37.23 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 110.49 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -54.58 -62.72 1.47 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.133 -0.979 . . . . 0.0 109.549 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.735 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.5 m -53.31 -39.66 64.19 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.446 -0.784 . . . . 0.0 109.717 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.56 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.1 m -57.59 -62.1 2.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 110.509 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 24.3 ttpt -49.55 -61.31 2.18 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.33 -0.856 . . . . 0.0 109.469 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -47.47 -29.6 2.83 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.2 0.524 . . . . 0.0 110.499 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -79.25 -20.88 47.08 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.176 -0.952 . . . . 0.0 108.756 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.16 37.79 0.68 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.792 ' CD2' HG12 ' A' ' 44' ' ' VAL . 11.2 m-85 -124.31 168.0 13.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.367 -1.078 . . . . 0.0 110.457 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.971 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -76.7 -28.79 17.65 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-O 122.21 1.005 . . . . 0.0 108.31 178.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.591 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 176.99 -159.1 25.32 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.68 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.18 -179.75 36.1 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.428 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 O-C-N 121.331 -1.1 . . . . 0.0 110.721 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 5.8 t . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 121.065 0.46 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.73 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-85 -105.83 167.2 9.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 109.548 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.81 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.3 m -143.59 119.51 10.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.706 -1.246 . . . . 0.0 110.891 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.971 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.04 140.81 30.73 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.732 0.777 . . . . 0.0 110.633 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.87 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -127.33 166.64 23.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.14 0.495 . . . . 0.0 109.84 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.722 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.27 89.95 3.15 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 177.92 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.424 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.779 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.742 -176.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.401 0.62 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.898 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -157.59 158.36 35.42 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.909 0.862 . . . . 0.0 111.329 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.831 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.8 m -131.06 139.17 49.87 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.781 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.6 OUTLIER -109.75 145.95 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 122.038 0.923 . . . . 0.0 111.409 -178.829 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.734 HG13 ' N ' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -122.27 179.02 2.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.938 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.734 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -98.02 108.44 21.14 Favored 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.462 -179.938 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -98.27 55.45 1.13 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.119 -0.988 . . . . 0.0 109.661 179.556 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.494 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -67.15 -26.75 66.81 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.319 0.58 . . . . 0.0 110.103 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.494 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -61.78 -12.67 36.06 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.693 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 36.8 m0 -91.98 -17.97 24.36 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.266 -1.138 . . . . 0.0 110.303 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.469 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 108.0 140.04 9.19 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -40.93 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.591 -0.946 . . . . 0.0 110.122 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.8 t -110.22 151.53 27.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.188 -0.945 . . . . 0.0 110.77 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.862 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.71 -31.25 8.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.571 -0.706 . . . . 0.0 109.965 179.666 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.862 HD11 HD12 ' A' ' 14' ' ' LEU . 4.0 mm -109.93 -143.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.568 -0.708 . . . . 0.0 110.127 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.553 ' H ' HG22 ' A' ' 15' ' ' ILE . 25.8 m-20 -125.69 -20.8 4.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.369 -0.832 . . . . 0.0 109.876 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.486 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.3 m -105.13 -30.18 9.9 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.34 -0.85 . . . . 0.0 109.752 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.49 ' OG1' ' HB ' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -39.74 -53.99 2.14 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.288 -0.882 . . . . 0.0 109.205 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.593 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.2 t -58.74 -51.53 69.57 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.358 -0.839 . . . . 0.0 109.072 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.539 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.39 -41.21 19.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.804 -0.56 . . . . 0.0 110.804 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -54.29 -61.71 2.13 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.103 -0.998 . . . . 0.0 109.766 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.693 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -53.74 -37.53 63.45 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.398 -0.814 . . . . 0.0 110.03 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.577 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 63.6 m -58.43 -61.88 2.26 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.341 -0.85 . . . . 0.0 110.635 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.646 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 6.0 mtpt -50.69 -60.68 2.8 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.305 -0.872 . . . . 0.0 109.6 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -47.16 -29.69 2.45 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.182 0.515 . . . . 0.0 110.472 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 26' ' ' ARG . 0.3 OUTLIER -79.6 -23.49 42.66 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.256 -0.903 . . . . 0.0 108.815 179.42 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.25 41.15 0.37 Allowed Glycine 0 N--CA 1.484 1.846 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.716 ' CD1' HG12 ' A' ' 44' ' ' VAL . 27.7 m-85 -129.44 169.2 15.23 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.276 -1.132 . . . . 0.0 110.592 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.969 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.99 -28.3 13.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 122.19 0.995 . . . . 0.0 108.371 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.91 -158.57 23.69 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.712 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.48 -162.22 12.25 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.561 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 O-C-N 121.305 -1.115 . . . . 0.0 111.01 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.922 0.391 . . . . 0.0 110.558 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.719 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.5 m-30 -99.45 163.16 12.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.001 -1.062 . . . . 0.0 109.649 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.781 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.7 m -140.09 119.09 12.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.816 -1.177 . . . . 0.0 110.763 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.969 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.68 139.91 32.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.537 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.898 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.46 166.79 22.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-O 121.207 0.527 . . . . 0.0 109.801 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.729 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.34 90.03 3.19 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 177.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.422 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.723 -176.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.42 0.629 . . . . 0.0 110.375 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.895 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.95 158.09 41.57 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.377 -0.827 . . . . 0.0 111.085 178.882 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.828 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.18 138.8 51.95 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.759 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 18.5 mtm -109.85 146.19 35.5 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.113 0.959 . . . . 0.0 111.484 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.747 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -124.28 179.53 2.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.708 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.747 ' H ' HD12 ' A' ' 5' ' ' ILE . 8.0 mttt -101.37 109.23 21.03 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 121.634 -0.666 . . . . 0.0 110.336 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.688 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -93.83 55.24 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.105 -0.997 . . . . 0.0 109.511 179.503 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.554 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.9 OUTLIER -65.49 -28.99 69.59 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.323 0.582 . . . . 0.0 110.173 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.554 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -63.14 -11.07 37.13 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 37.2 m0 -93.72 -19.38 21.13 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.257 -1.143 . . . . 0.0 110.247 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 105.69 141.35 10.54 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.462 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -38.61 154.89 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.575 -0.956 . . . . 0.0 110.087 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 31.7 t -94.27 150.06 20.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.144 -0.972 . . . . 0.0 110.58 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.85 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.46 -31.2 8.65 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.463 -0.773 . . . . 0.0 110.034 179.729 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.85 HD13 ' C ' ' A' ' 14' ' ' LEU . 2.4 mm -115.15 -155.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.494 -0.754 . . . . 0.0 110.321 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.664 ' H ' HG22 ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.35 -26.1 11.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.688 179.666 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.492 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.3 OUTLIER -104.0 -28.95 11.23 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.457 -0.777 . . . . 0.0 109.638 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.565 HG21 HD21 ' A' ' 14' ' ' LEU . 3.0 m -39.02 -55.4 1.58 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.376 -0.828 . . . . 0.0 109.358 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.588 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -58.19 -52.28 66.21 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.342 -0.849 . . . . 0.0 108.977 178.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.431 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.87 -42.25 47.32 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.704 -0.622 . . . . 0.0 110.441 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -51.42 -59.05 4.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 0.0 109.709 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.688 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -57.35 -37.42 72.56 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.369 -0.832 . . . . 0.0 109.966 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.545 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.9 m -59.83 -60.06 4.44 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.259 -0.901 . . . . 0.0 110.568 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' O ' ' N ' ' A' ' 27' ' ' GLY . 16.9 mtpt -51.46 -60.76 2.78 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.637 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -43.52 -29.81 0.51 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.147 0.498 . . . . 0.0 110.686 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.571 ' HG2' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -79.79 -28.44 40.28 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.217 -0.927 . . . . 0.0 108.703 179.39 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 129.75 37.57 0.36 Allowed Glycine 0 N--CA 1.484 1.865 0 N-CA-C 108.678 -1.769 . . . . 0.0 108.678 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.571 ' CE2' ' HG2' ' A' ' 26' ' ' ARG . 20.5 m-85 -121.48 168.11 12.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.334 -1.098 . . . . 0.0 110.697 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.935 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.83 -28.12 13.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-O 122.102 0.953 . . . . 0.0 108.564 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.585 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.66 -160.3 26.8 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.642 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -161.31 172.53 37.56 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.615 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.305 -1.341 0 O-C-N 121.081 -1.246 . . . . 0.0 111.053 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.688 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.3 t . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 121.111 0.481 . . . . 0.0 110.84 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.702 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 8.6 m-85 -109.99 169.27 8.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.12 -0.987 . . . . 0.0 109.133 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.759 ' O ' ' HA ' ' A' ' 4' ' ' MET . 86.2 m -143.99 118.98 9.99 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.701 -1.249 . . . . 0.0 110.725 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.935 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.83 139.04 31.62 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.486 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.895 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.24 23.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.726 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.23 89.82 3.12 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.431 ' O ' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.766 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.789 -176.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.516 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.487 0.66 . . . . 0.0 110.462 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.899 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.65 159.02 43.21 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.396 -0.815 . . . . 0.0 110.882 178.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.788 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -129.41 138.5 51.52 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.785 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.2 OUTLIER -110.15 142.66 41.35 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-O 122.051 0.929 . . . . 0.0 111.248 -178.888 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.755 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -120.9 178.14 2.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.755 ' H ' HD12 ' A' ' 5' ' ' ILE . 8.7 mttp -98.96 108.78 21.55 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.794 -0.566 . . . . 0.0 110.075 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.702 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.7 OUTLIER -98.1 55.68 1.17 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.118 -0.989 . . . . 0.0 109.873 179.764 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -21.3 64.72 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.279 0.561 . . . . 0.0 110.071 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.54 -6.84 51.43 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.744 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.281 -1.129 . . . . 0.0 110.215 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 108.77 140.68 9.18 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.456 ' C ' ' CD ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -41.29 155.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.458 -1.025 . . . . 0.0 110.173 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.5 t -100.22 153.28 19.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.173 -0.955 . . . . 0.0 110.762 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.794 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -107.35 -31.41 8.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.562 -0.711 . . . . 0.0 109.985 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.794 HD11 HD12 ' A' ' 14' ' ' LEU . 2.9 mm -117.37 -150.8 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.487 -0.758 . . . . 0.0 110.274 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.62 ' H ' HG22 ' A' ' 15' ' ' ILE . 4.5 m-20 -113.44 -26.13 8.47 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.443 -0.785 . . . . 0.0 109.427 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.469 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -99.21 -29.76 12.65 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.5 -0.75 . . . . 0.0 109.487 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.654 HG21 HD21 ' A' ' 14' ' ' LEU . 90.0 m -40.38 -49.72 2.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.38 -0.825 . . . . 0.0 109.276 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -64.31 -50.53 67.45 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.345 -0.847 . . . . 0.0 109.073 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.512 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.81 -39.64 18.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.734 -0.604 . . . . 0.0 110.662 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 10.2 m170 -53.03 -61.34 2.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.212 -0.93 . . . . 0.0 109.677 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.744 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.8 m -55.84 -38.75 70.47 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.459 -0.776 . . . . 0.0 109.87 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.54 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.3 m -58.8 -61.86 2.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.331 -0.856 . . . . 0.0 110.313 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.5 OUTLIER -50.66 -61.17 2.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.386 -0.821 . . . . 0.0 109.628 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -51.16 -27.6 9.04 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.15 0.5 . . . . 0.0 110.502 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 22' ' ' SER . 1.4 tpt180 -78.52 -22.43 47.36 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.2 -0.938 . . . . 0.0 108.677 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.36 38.54 0.51 Allowed Glycine 0 N--CA 1.484 1.871 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.635 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.2 m-85 -128.56 170.9 12.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.258 -1.142 . . . . 0.0 110.641 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.992 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.87 -28.32 15.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 CA-C-O 122.199 1.0 . . . . 0.0 108.433 179.197 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.588 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.0 -157.74 22.97 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.719 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.54 -166.2 18.87 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.57 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.408 0 O-C-N 121.292 -1.122 . . . . 0.0 110.686 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.702 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.5 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.03 0.443 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.746 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.9 m-85 -108.5 166.65 10.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.009 -1.057 . . . . 0.0 109.515 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.785 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.16 120.15 12.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.774 -1.204 . . . . 0.0 110.713 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.992 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.68 137.61 32.71 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.462 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.899 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.97 166.47 22.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.177 0.513 . . . . 0.0 109.774 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.707 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.19 90.58 3.12 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.516 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.756 -176.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.52 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.413 0.625 . . . . 0.0 110.418 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.93 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -150.04 158.08 43.8 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.073 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.798 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -128.59 138.71 52.35 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.796 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.04 143.06 40.6 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 122.064 0.935 . . . . 0.0 111.569 -178.784 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.788 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -120.54 -179.85 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.795 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.788 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -103.06 110.59 22.57 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 121.744 -0.598 . . . . 0.0 110.418 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.644 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.3 OUTLIER -100.69 54.81 0.87 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.044 -1.035 . . . . 0.0 109.692 179.428 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -23.6 67.41 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.285 0.564 . . . . 0.0 110.058 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.96 -7.71 44.79 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.8 m0 -95.47 -19.52 19.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.252 -1.146 . . . . 0.0 110.295 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 106.93 140.86 9.87 Favored Glycine 0 N--CA 1.488 2.125 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.507 ' CD ' ' N ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -39.28 160.65 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.994 . . . . 0.0 110.282 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.1 t -103.05 152.82 20.92 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.242 -0.911 . . . . 0.0 110.597 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.771 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.61 -30.89 9.21 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 110.064 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.771 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.5 mm -116.77 -148.41 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.525 -0.734 . . . . 0.0 110.283 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.635 ' H ' HG22 ' A' ' 15' ' ' ILE . 8.9 m-20 -114.58 -25.81 8.17 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.465 -0.772 . . . . 0.0 109.396 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.49 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -101.92 -29.85 11.58 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.565 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.624 HG21 HD21 ' A' ' 14' ' ' LEU . 4.4 m -39.42 -53.4 2.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.385 -0.822 . . . . 0.0 109.294 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.575 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 5.5 t -60.24 -46.14 90.83 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.376 -0.827 . . . . 0.0 109.038 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.502 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.53 -39.52 64.73 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.689 -0.632 . . . . 0.0 110.362 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.56 -59.21 4.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.174 -0.954 . . . . 0.0 109.617 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.688 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 9.0 t -58.44 -36.66 73.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.432 -0.792 . . . . 0.0 110.033 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.545 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 70.0 m -61.35 -60.86 3.07 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.316 -0.865 . . . . 0.0 110.443 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.593 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -52.56 -59.61 4.24 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.411 -0.806 . . . . 0.0 109.808 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -44.17 -30.06 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.228 0.537 . . . . 0.0 110.504 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 3.1 ttm-85 -79.72 -28.85 40.51 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.163 -0.961 . . . . 0.0 108.798 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 132.07 39.21 0.24 Allowed Glycine 0 N--CA 1.483 1.825 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.593 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.1 m-85 -125.23 170.09 11.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.375 -1.074 . . . . 0.0 110.692 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.936 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -79.56 -28.47 13.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.117 0.96 . . . . 0.0 108.502 179.124 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.579 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.27 -158.59 24.22 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.678 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -160.77 172.48 37.11 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.612 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.382 0 O-C-N 121.181 -1.188 . . . . 0.0 110.879 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.644 ' O ' ' N ' ' A' ' 7' ' ' LYS . 3.1 t . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 121.009 0.433 . . . . 0.0 110.76 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.739 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.3 m-85 -107.62 168.87 8.95 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.067 -1.02 . . . . 0.0 108.714 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.796 ' O ' ' HA ' ' A' ' 4' ' ' MET . 78.1 m -141.0 119.69 12.48 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.703 -1.248 . . . . 0.0 111.053 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.936 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.34 136.6 33.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.745 0.783 . . . . 0.0 110.224 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.93 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.0 165.62 23.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.703 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -75.84 90.65 2.93 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 106.606 -1.627 . . . . 0.0 106.606 177.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.52 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.752 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.791 -176.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.482 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.403 0.621 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.846 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -158.03 159.66 36.61 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.339 -0.85 . . . . 0.0 111.308 179.129 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.791 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.4 m -129.07 139.28 52.08 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.794 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -110.13 146.36 35.61 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.012 0.911 . . . . 0.0 111.609 -178.621 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.781 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -121.99 179.59 2.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.781 ' H ' HD12 ' A' ' 5' ' ' ILE . 6.3 mttp -100.63 108.97 21.0 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.74 -0.6 . . . . 0.0 110.597 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.697 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -95.37 56.0 1.8 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.092 -1.005 . . . . 0.0 109.592 179.316 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -69.65 -18.66 63.6 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.4 179.989 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.475 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -77.93 -0.79 76.83 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.726 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 42.1 m0 -100.84 -15.47 17.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -1.169 . . . . 0.0 110.251 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.89 141.44 9.8 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.491 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -41.3 165.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.461 -1.023 . . . . 0.0 110.19 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.3 t -107.84 153.75 22.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.135 -0.978 . . . . 0.0 110.89 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.773 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -108.33 -30.74 8.17 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 121.556 0.693 . . . . 0.0 110.006 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.721 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.6 mm -119.52 -147.92 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.556 -0.715 . . . . 0.0 110.351 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.613 ' H ' HG22 ' A' ' 15' ' ' ILE . 21.1 m-20 -116.12 -25.6 7.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.43 -0.794 . . . . 0.0 109.372 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.64 -30.0 12.72 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.472 -0.767 . . . . 0.0 109.536 179.328 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.773 HG21 HD21 ' A' ' 14' ' ' LEU . 44.9 m -41.05 -54.59 2.77 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.339 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.621 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.0 t -60.23 -49.99 75.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.306 -0.871 . . . . 0.0 109.076 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.488 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.65 -41.55 43.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.739 -0.601 . . . . 0.0 110.715 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -51.51 -59.83 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.714 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.726 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.5 m -56.35 -37.48 70.07 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.405 -0.809 . . . . 0.0 109.817 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.542 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.0 m -59.32 -61.99 2.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.431 -0.793 . . . . 0.0 110.526 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 7.8 mtpt -50.25 -60.22 3.19 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.418 -0.801 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.05 -30.0 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.312 0.577 . . . . 0.0 110.139 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.41 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 36.8 tpt85 -78.58 -21.38 48.72 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.333 -0.855 . . . . 0.0 108.822 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 122.03 40.81 0.5 Allowed Glycine 0 N--CA 1.484 1.837 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.622 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.8 m-85 -128.81 169.53 14.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -1.083 . . . . 0.0 110.654 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.905 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -78.58 -28.82 14.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.566 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.43 -157.33 21.1 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.693 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.23 -165.86 17.93 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.569 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 O-C-N 121.185 -1.185 . . . . 0.0 110.953 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.697 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.9 t . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 121.073 0.463 . . . . 0.0 110.749 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.682 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 4.6 m-85 -110.17 167.1 10.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.1 -1.0 . . . . 0.0 109.352 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.794 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.9 m -141.6 119.34 11.78 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.648 -1.282 . . . . 0.0 110.834 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.905 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -86.21 139.96 30.57 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.793 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.846 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.53 166.89 22.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.181 0.515 . . . . 0.0 109.707 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.709 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 90.35 3.19 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 177.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.786 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.415 0.626 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.892 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -160.49 158.6 29.58 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.832 0.825 . . . . 0.0 111.222 178.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.809 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.32 138.38 51.54 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.786 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.9 OUTLIER -110.17 141.26 43.33 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-O 122.091 0.948 . . . . 0.0 111.272 -178.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.778 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -119.87 179.44 2.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.798 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.778 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -102.48 105.39 15.93 Favored 'General case' 0 C--N 1.294 -1.81 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.706 ' N ' ' O ' ' A' ' 40' ' ' CYS . 43.3 mmtt -92.05 56.47 2.87 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.968 -1.082 . . . . 0.0 109.561 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.7 OUTLIER -64.93 -24.88 67.66 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.169 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.475 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -67.24 -7.9 47.53 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.738 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.2 m0 -94.78 -17.27 22.3 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -1.165 . . . . 0.0 110.335 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.65 140.59 8.2 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.415 ' H ' ' HD2' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -44.84 157.35 0.07 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.431 -1.041 . . . . 0.0 109.836 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 18.0 t -105.59 152.35 23.2 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.115 -0.99 . . . . 0.0 111.087 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 1.042 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -111.92 -30.59 7.22 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.553 0.692 . . . . 0.0 109.934 179.471 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 1.042 HD11 HD12 ' A' ' 14' ' ' LEU . 1.5 mm -107.2 -148.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.502 -0.749 . . . . 0.0 110.466 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.545 ' H ' HG22 ' A' ' 15' ' ' ILE . 2.9 m-20 -122.55 -25.24 4.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.383 -0.823 . . . . 0.0 109.677 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.482 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -103.07 -29.89 11.08 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.4 -0.812 . . . . 0.0 109.512 179.505 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.482 ' C ' ' O ' ' A' ' 17' ' ' THR . 18.4 m -40.59 -47.4 2.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.302 -0.874 . . . . 0.0 109.092 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.629 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.2 t -66.9 -50.33 62.78 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-O 121.793 0.806 . . . . 0.0 109.112 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.476 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -48.17 -39.83 22.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.704 -0.623 . . . . 0.0 110.519 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.407 ' C ' ' CD2' ' A' ' 21' ' ' HIS . 3.7 t-160 -54.37 -61.74 2.11 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.194 -0.942 . . . . 0.0 109.595 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.738 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.3 m -52.81 -39.16 62.14 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.371 -0.831 . . . . 0.0 109.74 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.53 ' SG ' ' HA3' ' A' ' 31' ' ' GLY . 57.7 m -57.6 -62.05 2.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.662 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLY . 9.5 mtpt -49.39 -61.02 2.33 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.383 -0.823 . . . . 0.0 109.278 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m-20 -45.79 -31.41 2.04 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.189 0.519 . . . . 0.0 110.347 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -20.65 48.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.265 -0.897 . . . . 0.0 108.814 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 120.21 40.85 0.57 Allowed Glycine 0 N--CA 1.484 1.856 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.626 ' CD1' HG12 ' A' ' 44' ' ' VAL . 34.8 m-85 -126.59 168.47 14.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.37 -1.077 . . . . 0.0 110.696 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.988 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.56 -28.44 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 CA-C-O 122.141 0.972 . . . . 0.0 108.553 179.196 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.603 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.99 -159.2 24.72 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.713 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.65 -162.52 12.61 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.578 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 O-C-N 121.235 -1.156 . . . . 0.0 110.893 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.706 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 121.122 0.486 . . . . 0.0 110.871 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.749 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 11.4 m-85 -106.86 169.94 8.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.116 -0.99 . . . . 0.0 109.395 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.786 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.5 m -146.6 119.02 8.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.645 -1.285 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.988 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -84.9 138.5 32.48 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.652 0.739 . . . . 0.0 110.364 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.892 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.73 166.68 22.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-O 121.136 0.493 . . . . 0.0 109.796 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.725 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.21 89.72 3.11 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.815 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.44 ' OXT' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.753 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.796 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.44 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.3 ttp180 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.365 0.602 . . . . 0.0 110.381 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.921 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -151.85 157.8 42.38 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.232 178.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.845 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.82 139.1 51.3 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.825 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.99 144.5 41.22 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-O 122.097 0.951 . . . . 0.0 111.589 -178.727 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.769 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.32 179.36 2.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.704 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.769 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -97.63 112.03 24.07 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.556 -0.715 . . . . 0.0 110.456 -179.918 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.665 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -94.3 54.69 1.9 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.075 -1.016 . . . . 0.0 109.699 179.606 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.45 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.1 OUTLIER -70.28 -26.73 63.94 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.36 0.6 . . . . 0.0 110.1 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.45 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -65.19 -9.84 44.13 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.731 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.06 -16.72 22.46 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.338 -1.095 . . . . 0.0 110.337 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.504 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 110.73 141.81 8.92 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.504 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -34.23 151.45 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.646 -0.914 . . . . 0.0 110.304 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 15' ' ' ILE . 17.9 t -95.69 152.19 18.68 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.302 -0.874 . . . . 0.0 110.706 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.985 ' O ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -115.05 -31.7 5.96 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.521 -0.737 . . . . 0.0 110.731 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.985 HD13 ' O ' ' A' ' 14' ' ' LEU . 3.4 mm -128.22 169.18 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.217 -0.927 . . . . 0.0 111.065 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -75.22 -21.21 58.81 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.444 -0.785 . . . . 0.0 110.453 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.471 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.1 OUTLIER -106.62 -39.97 5.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.197 -0.939 . . . . 0.0 109.643 179.781 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.618 HG21 HD11 ' A' ' 14' ' ' LEU . 99.0 m -41.24 -39.05 1.25 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.273 -0.892 . . . . 0.0 108.654 179.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.572 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 6.2 t -71.54 -49.35 41.56 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.476 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.95 -35.94 62.3 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.749 -0.594 . . . . 0.0 110.307 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -53.6 -61.84 2.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.253 -0.905 . . . . 0.0 109.328 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.731 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 14.5 m -54.94 -41.94 71.67 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.41 -0.806 . . . . 0.0 109.505 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.546 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.4 m -56.29 -61.87 2.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.319 -0.863 . . . . 0.0 110.413 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 15.8 mtmt -50.1 -61.12 2.34 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.418 -0.801 . . . . 0.0 109.629 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -47.35 -29.52 2.61 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.211 0.529 . . . . 0.0 110.504 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -22.05 45.15 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.216 -0.928 . . . . 0.0 108.846 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 123.32 37.88 0.58 Allowed Glycine 0 N--CA 1.484 1.886 0 N-CA-C 108.802 -1.719 . . . . 0.0 108.802 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.768 ' CD2' HG12 ' A' ' 44' ' ' VAL . 6.8 m-85 -123.74 169.69 11.26 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -1.076 . . . . 0.0 110.463 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.999 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -80.45 -28.08 11.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 CA-C-O 122.202 1.001 . . . . 0.0 108.343 178.88 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.576 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.93 -159.46 24.42 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.64 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.41 172.36 36.8 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.612 ' C ' ' OD1' ' A' ' 32' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 O-C-N 121.016 -1.285 . . . . 0.0 111.458 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.665 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.2 t . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 121.141 0.496 . . . . 0.0 111.053 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.692 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-30 -110.72 168.75 9.24 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 108.762 178.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.825 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -142.0 118.54 10.96 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.717 -1.239 . . . . 0.0 110.776 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.999 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.24 137.89 32.7 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.218 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.921 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.88 166.63 21.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.139 0.495 . . . . 0.0 109.799 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.74 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.26 89.76 3.14 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.774 -176.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.42 ' C ' ' OG1' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.458 0.647 . . . . 0.0 110.442 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.852 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -167.53 159.28 12.05 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.792 0.806 . . . . 0.0 111.231 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.837 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.42 139.09 50.61 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.777 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 46.4 mtm -108.01 143.75 36.27 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.12 0.962 . . . . 0.0 111.548 -178.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.77 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -118.49 179.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.645 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.77 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.15 107.92 19.46 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.656 -0.652 . . . . 0.0 110.365 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.69 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -95.11 55.7 1.83 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.128 -0.982 . . . . 0.0 109.523 179.408 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.37 -17.19 64.18 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.256 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.24 -4.3 78.65 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.743 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 40.4 m0 -97.55 -24.71 15.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.389 -1.065 . . . . 0.0 110.337 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.34 142.0 7.08 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -40.59 163.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.503 -0.998 . . . . 0.0 110.281 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 t -105.43 151.87 23.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.189 -0.945 . . . . 0.0 110.788 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.971 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -107.35 -31.57 8.13 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.468 -0.77 . . . . 0.0 109.972 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.702 HD13 ' C ' ' A' ' 14' ' ' LEU . 4.2 mm -120.87 -147.23 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.517 -0.739 . . . . 0.0 110.26 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.632 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.9 OUTLIER -114.38 -26.66 7.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.437 -0.79 . . . . 0.0 109.241 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.449 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.68 -30.97 12.15 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.487 -0.758 . . . . 0.0 109.577 179.534 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.971 HG21 HD21 ' A' ' 14' ' ' LEU . 25.8 m -40.83 -47.96 3.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.381 -0.824 . . . . 0.0 109.29 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.598 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.3 t -67.33 -48.59 67.1 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.376 -0.827 . . . . 0.0 109.117 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.502 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.53 -38.51 54.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.692 -0.63 . . . . 0.0 110.534 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.09 -59.98 3.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.165 -0.959 . . . . 0.0 109.622 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.743 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.8 m -57.58 -38.87 75.58 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.382 -0.824 . . . . 0.0 109.706 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.558 ' SG ' ' HA3' ' A' ' 31' ' ' GLY . 60.5 m -60.13 -61.6 2.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.638 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.96 -61.0 2.49 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.607 179.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -51.04 -27.94 9.11 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-O 121.175 0.512 . . . . 0.0 110.601 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 22' ' ' SER . 13.4 tpt180 -78.04 -23.39 48.16 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.782 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.71 35.68 0.59 Allowed Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.638 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.4 m-85 -125.15 170.5 11.16 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -1.115 . . . . 0.0 110.752 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.937 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.01 -28.66 19.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-O 122.234 1.016 . . . . 0.0 108.298 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 175.99 -157.62 23.77 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.71 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.61 173.76 37.19 Favored Glycine 0 N--CA 1.488 2.111 0 C-N-CA 119.696 -1.24 . . . . 0.0 110.006 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.433 HD22 ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.304 -1.395 0 O-C-N 121.389 -1.065 . . . . 0.0 110.667 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.69 ' O ' ' N ' ' A' ' 7' ' ' LYS . 7.9 t . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 121.14 0.495 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.728 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.0 m-85 -107.09 166.38 10.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.159 -0.963 . . . . 0.0 109.322 178.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.777 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.01 119.37 12.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.671 -1.268 . . . . 0.0 111.012 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.937 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.41 138.48 33.47 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.796 0.808 . . . . 0.0 110.539 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.852 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.18 166.14 22.93 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.727 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.13 89.87 3.07 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.123 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.434 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.861 -176.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.435 0.636 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.898 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -154.89 158.64 39.63 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.348 -0.845 . . . . 0.0 111.106 178.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.846 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.33 138.06 50.24 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.656 0.741 . . . . 0.0 109.028 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.712 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -107.55 143.51 35.86 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 122.003 0.906 . . . . 0.0 111.209 -179.159 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.78 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -122.56 178.05 3.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.78 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -97.43 109.47 22.22 Favored 'General case' 0 C--N 1.296 -1.738 0 O-C-N 121.803 -0.561 . . . . 0.0 110.436 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -97.51 55.73 1.26 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.0 109.571 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.501 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -68.54 -20.28 64.54 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.434 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.501 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -75.47 0.96 59.01 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.7 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 41.2 m0 -102.8 -17.78 15.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -1.146 . . . . 0.0 110.336 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.14 140.77 8.41 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.547 ' O ' ' CD ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -43.7 162.51 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.422 -1.046 . . . . 0.0 110.447 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.5 t -108.6 148.0 30.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.275 -0.891 . . . . 0.0 110.396 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.904 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.88 -32.57 8.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.4 -0.813 . . . . 0.0 110.392 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.904 HD11 HD12 ' A' ' 14' ' ' LEU . 4.0 mm -109.18 -146.57 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.611 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -117.59 -25.0 7.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 179.497 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.451 ' O ' ' C ' ' A' ' 18' ' ' THR . 2.4 m -103.28 -24.2 13.54 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.539 -0.726 . . . . 0.0 109.441 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.451 ' C ' ' O ' ' A' ' 17' ' ' THR . 24.8 m -40.41 -52.26 2.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 0.0 109.389 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 24.1 t -64.02 -50.49 68.27 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.289 -0.882 . . . . 0.0 109.136 178.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.454 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -46.21 -40.3 11.12 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.729 -0.607 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -53.11 -60.64 3.03 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.198 -0.939 . . . . 0.0 109.828 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.7 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -56.98 -37.19 71.25 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.416 -0.803 . . . . 0.0 110.088 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 57.8 m -59.47 -62.07 2.15 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 110.319 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 25.4 tttt -50.84 -60.63 2.87 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 109.626 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -46.66 -30.54 2.39 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.215 0.531 . . . . 0.0 110.551 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -79.11 -23.1 44.31 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.221 -0.925 . . . . 0.0 108.705 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.16 37.77 0.55 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.987 -1.645 . . . . 0.0 108.987 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.772 ' CD2' HG12 ' A' ' 44' ' ' VAL . 9.0 m-85 -122.61 168.62 11.94 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.348 -1.089 . . . . 0.0 110.601 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.935 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.51 -28.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-O 122.176 0.988 . . . . 0.0 108.603 179.141 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.602 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.04 -159.97 25.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.724 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.8 -172.1 27.64 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.784 -1.198 . . . . 0.0 110.117 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.555 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.382 -1.069 . . . . 0.0 110.578 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.699 ' O ' ' N ' ' A' ' 7' ' ' LYS . 8.3 t . . . . . 0 N--CA 1.485 1.311 0 CA-C-O 120.992 0.425 . . . . 0.0 110.454 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.707 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 14.6 m-85 -103.03 163.16 12.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.005 -1.06 . . . . 0.0 109.432 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.724 ' HA ' ' HA2' ' A' ' 31' ' ' GLY . 82.1 m -139.28 119.69 13.88 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.741 -1.224 . . . . 0.0 110.677 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.935 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -84.52 139.97 31.77 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.211 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.898 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.4 m -127.39 167.07 22.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 CA-C-O 121.256 0.551 . . . . 0.0 110.032 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.728 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.34 89.69 3.18 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.421 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.77 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.757 -176.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.421 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.374 0.606 . . . . 0.0 110.406 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.894 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -153.78 158.88 41.57 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 111.166 178.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.828 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -130.48 138.79 50.44 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.777 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -108.77 143.09 38.37 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 122.033 0.92 . . . . 0.0 111.319 -178.872 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.798 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -119.01 179.52 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.65 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.736 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.798 ' H ' HD12 ' A' ' 5' ' ' ILE . 1.3 mtmp? -102.17 104.51 15.1 Favored 'General case' 0 C--N 1.295 -1.804 0 O-C-N 121.706 -0.621 . . . . 0.0 110.399 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.679 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.3 mmpt? -91.13 56.37 3.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.989 -1.07 . . . . 0.0 109.434 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.485 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -65.73 -25.29 67.23 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.329 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.485 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -68.2 -6.96 49.6 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.719 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.4 m0 -95.8 -20.04 19.15 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.303 -1.116 . . . . 0.0 110.365 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.479 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.43 142.13 9.52 Favored Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -40.7 163.71 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.538 -0.978 . . . . 0.0 110.063 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.1 t -94.97 151.55 19.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 110.926 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 1.046 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -111.26 -31.5 7.05 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.476 -0.765 . . . . 0.0 109.965 179.494 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.668 HG22 ' H ' ' A' ' 16' ' ' ASP . 6.2 mm -119.86 -145.65 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.513 -0.742 . . . . 0.0 110.075 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.668 ' H ' HG22 ' A' ' 15' ' ' ILE . 40.0 m-20 -116.37 -21.22 9.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.234 -0.916 . . . . 0.0 109.577 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.463 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -109.58 -25.11 10.62 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.482 -0.761 . . . . 0.0 109.46 179.431 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 1.046 HG21 HD21 ' A' ' 14' ' ' LEU . 57.9 m -40.78 -56.78 2.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.478 -0.764 . . . . 0.0 109.309 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.603 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 14.1 t -58.45 -52.64 64.76 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.305 -0.872 . . . . 0.0 109.054 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.49 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.76 -42.81 26.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.715 -0.616 . . . . 0.0 110.609 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -52.71 -60.75 2.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.947 . . . . 0.0 109.733 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.719 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.5 m -53.02 -37.88 61.87 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.391 -0.818 . . . . 0.0 109.632 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.547 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 58.2 m -60.58 -60.43 3.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.46 -0.775 . . . . 0.0 110.449 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.571 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -49.69 -61.06 2.33 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.366 -0.834 . . . . 0.0 109.59 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -47.69 -31.42 4.66 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 121.313 0.577 . . . . 0.0 110.241 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -76.46 -21.56 55.73 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.252 -0.905 . . . . 0.0 108.654 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 119.93 38.99 0.67 Allowed Glycine 0 N--CA 1.483 1.803 0 N-CA-C 108.84 -1.704 . . . . 0.0 108.84 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.638 ' CD1' HG12 ' A' ' 44' ' ' VAL . 37.2 m-85 -124.75 168.32 13.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.381 -1.07 . . . . 0.0 110.78 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.955 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.44 -28.83 16.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-O 122.177 0.989 . . . . 0.0 108.443 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.6 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.39 -159.05 24.93 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.681 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.08 178.93 36.84 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.416 ' ND2' ' HB2' ' A' ' 41' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 O-C-N 121.302 -1.117 . . . . 0.0 110.976 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.679 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.8 t . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.139 0.495 . . . . 0.0 110.928 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.725 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 12.1 m-85 -107.67 168.39 9.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 109.37 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.777 ' O ' ' HA ' ' A' ' 4' ' ' MET . 81.3 m -145.05 118.12 8.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.646 -1.284 . . . . 0.0 110.907 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.955 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.93 139.11 32.8 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.56 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.894 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.84 166.88 22.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 CA-C-O 121.157 0.503 . . . . 0.0 109.695 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.713 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.25 90.19 3.14 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 177.858 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.436 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.757 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.694 -176.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.8 ttp180 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.398 0.618 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.901 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -147.77 158.64 44.12 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.051 179.061 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.803 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -129.51 139.58 51.51 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 177.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.799 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 25.8 mtm -108.5 145.63 34.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 122.094 0.949 . . . . 0.0 111.715 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.771 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -121.14 179.8 2.12 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.541 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.771 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -104.25 110.83 23.19 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 110.355 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.666 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.7 mmpt? -99.89 54.82 0.93 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.114 -0.991 . . . . 0.0 109.616 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -62.57 -26.06 68.39 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.366 0.603 . . . . 0.0 110.13 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.61 -9.56 45.27 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.712 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.0 m0 -94.07 -22.48 18.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.257 -1.143 . . . . 0.0 110.344 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.22 141.15 9.2 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.521 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -38.73 161.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.627 -0.925 . . . . 0.0 110.392 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 13.1 t -102.32 154.39 19.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.243 -0.91 . . . . 0.0 110.623 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.956 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -106.62 -31.13 8.61 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.471 -0.768 . . . . 0.0 110.113 179.79 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.573 HG13 ' HG ' ' A' ' 14' ' ' LEU . 1.8 mt -116.26 -143.66 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.437 -0.789 . . . . 0.0 110.418 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.541 ' H ' HG22 ' A' ' 15' ' ' ILE . 17.9 m-20 -119.89 -15.1 8.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.501 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 31.4 m -113.66 -29.94 6.96 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.715 -0.615 . . . . 0.0 109.778 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.956 HG21 HD21 ' A' ' 14' ' ' LEU . 21.9 m -40.44 -50.44 2.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.373 -0.829 . . . . 0.0 109.254 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.8 t -61.71 -45.57 93.37 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.861 0.838 . . . . 0.0 108.923 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 17' ' ' THR . . . -52.72 -41.83 64.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.753 -0.592 . . . . 0.0 110.789 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -50.85 -58.53 5.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.089 -1.007 . . . . 0.0 109.677 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.712 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 18.8 m -57.84 -36.97 73.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.456 -0.778 . . . . 0.0 109.746 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.556 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.5 m -61.57 -60.85 3.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.365 -0.834 . . . . 0.0 110.408 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.657 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 2.0 mmmt -50.64 -60.7 2.77 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.404 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.6 m-20 -47.03 -29.78 2.3 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.274 0.559 . . . . 0.0 110.482 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -79.14 -23.03 44.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.213 -0.93 . . . . 0.0 108.778 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.61 35.81 0.63 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.657 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.3 m-85 -123.94 169.49 11.56 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.297 -1.119 . . . . 0.0 110.799 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.826 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.77 -29.31 16.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.57 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.94 -156.69 19.3 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.727 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -159.78 -169.49 23.15 Favored Glycine 0 N--CA 1.487 2.094 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.546 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.417 0 O-C-N 121.277 -1.131 . . . . 0.0 111.003 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.666 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.5 t . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.06 0.457 . . . . 0.0 110.667 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.697 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.5 m-85 -108.44 167.82 9.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.992 . . . . 0.0 109.228 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.799 ' O ' ' HA ' ' A' ' 4' ' ' MET . 79.8 m -140.78 120.49 13.39 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.693 -1.254 . . . . 0.0 111.18 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.826 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.1 OUTLIER -85.33 138.72 32.11 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.463 179.767 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.901 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.98 166.51 21.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.72 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.37 90.64 3.23 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 178.048 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.512 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.794 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.814 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.448 ' O ' ' HA ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.252 0.549 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.997 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -149.24 155.85 41.23 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 119.065 -1.054 . . . . 0.0 111.83 178.819 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.785 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.3 m -130.4 139.75 50.61 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.79 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 20.8 mtm -110.43 149.82 29.74 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 122.134 0.969 . . . . 0.0 111.842 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.764 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -126.56 179.51 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.668 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.764 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -101.44 108.5 20.11 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.699 -0.626 . . . . 0.0 110.34 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.723 ' N ' ' O ' ' A' ' 40' ' ' CYS . 2.0 mptp? -95.66 55.22 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.162 -0.961 . . . . 0.0 109.652 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.4 OUTLIER -63.52 -32.43 73.88 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.313 0.578 . . . . 0.0 110.123 179.832 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.4 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -57.77 -15.15 18.06 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.692 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 35.9 m0 -90.64 -25.04 20.31 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.309 -1.112 . . . . 0.0 110.45 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 113.77 141.77 7.95 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.491 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -42.32 168.1 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.411 -1.052 . . . . 0.0 110.261 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 18' ' ' THR . 22.4 t -121.85 154.14 37.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.0 110.628 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.992 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -114.09 -29.43 6.99 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.507 -0.745 . . . . 0.0 110.428 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.992 HD11 HD12 ' A' ' 14' ' ' LEU . 1.7 mm -104.24 -145.63 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.421 -0.799 . . . . 0.0 110.623 -179.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.553 ' H ' HG22 ' A' ' 15' ' ' ILE . 26.7 m-20 -123.34 -26.4 4.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.567 -0.708 . . . . 0.0 109.485 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.548 HG22 ' HD2' ' A' ' 21' ' ' HIS . 0.2 OUTLIER -102.04 -29.72 11.61 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.434 -0.791 . . . . 0.0 109.616 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 17' ' ' THR . 52.8 m -39.98 -45.87 1.97 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.424 -0.797 . . . . 0.0 109.357 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.9 t -73.05 -47.76 41.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.501 -0.749 . . . . 0.0 109.329 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.492 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.45 -43.53 62.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.573 -0.704 . . . . 0.0 110.787 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.548 ' HD2' HG22 ' A' ' 17' ' ' THR . 4.7 m170 -49.69 -58.77 4.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.147 -0.971 . . . . 0.0 109.558 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.692 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 71.5 p -57.57 -37.75 73.68 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 0.0 109.86 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.567 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.4 m -60.77 -59.71 4.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.458 -0.776 . . . . 0.0 110.435 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.63 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 14.3 tttp -50.86 -60.35 3.16 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.313 -0.867 . . . . 0.0 109.632 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -45.95 -30.3 1.73 Allowed 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.281 0.562 . . . . 0.0 110.459 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.468 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 1.1 tpt180 -78.61 -24.09 45.56 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.224 -0.922 . . . . 0.0 108.718 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.62 40.23 0.44 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.784 -1.727 . . . . 0.0 108.784 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.65 ' CD1' HG12 ' A' ' 44' ' ' VAL . 27.8 m-85 -127.24 167.86 15.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.386 -1.067 . . . . 0.0 110.624 -179.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.886 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.34 -28.88 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.124 0.964 . . . . 0.0 108.531 179.095 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.582 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.46 -156.84 20.1 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.704 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -160.49 -166.53 19.48 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.549 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.264 -1.139 . . . . 0.0 110.907 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.723 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.5 t . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.953 0.406 . . . . 0.0 110.569 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.732 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.7 m-85 -103.66 163.49 12.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.955 -1.091 . . . . 0.0 109.313 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.79 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -138.23 121.09 16.5 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.686 -1.259 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.886 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -87.63 139.88 30.09 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 119.729 -0.788 . . . . 0.0 110.704 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.997 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.85 167.62 19.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.708 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 91.3 3.24 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.906 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.793 -176.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.454 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.39 0.614 . . . . 0.0 110.384 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.905 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.47 158.85 43.17 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.21 179.034 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.802 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.4 m -129.39 138.86 51.74 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 177.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.802 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.83 145.06 40.11 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 122.024 0.916 . . . . 0.0 111.404 -178.802 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.788 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.36 177.94 3.7 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.788 ' H ' HD12 ' A' ' 5' ' ' ILE . 56.6 mttt -98.65 109.07 21.89 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.795 -0.565 . . . . 0.0 110.161 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.705 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -96.4 55.58 1.49 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.169 -0.957 . . . . 0.0 109.743 179.68 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -66.24 -22.3 66.32 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.094 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.481 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -69.15 -10.01 61.42 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.695 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.9 m0 -93.95 -16.16 24.23 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.189 -1.183 . . . . 0.0 110.274 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.46 140.96 9.04 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.53 ' O ' ' CD ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -40.22 162.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.445 -1.032 . . . . 0.0 110.142 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.1 t -100.09 155.19 17.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.0 110.851 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.651 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -113.61 -30.04 6.95 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.62 -0.675 . . . . 0.0 109.995 179.662 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.602 HG22 ' H ' ' A' ' 16' ' ' ASP . 5.7 mm -120.63 -141.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.615 -0.678 . . . . 0.0 110.202 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.602 ' H ' HG22 ' A' ' 15' ' ' ILE . 94.0 m-20 -124.73 -20.86 4.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.426 -0.796 . . . . 0.0 109.74 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.478 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.9 OUTLIER -107.61 -31.46 8.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.37 -0.831 . . . . 0.0 109.572 179.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.651 HG21 HD21 ' A' ' 14' ' ' LEU . 85.0 m -40.77 -50.44 3.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.34 -0.85 . . . . 0.0 109.053 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.8 t -61.47 -50.6 72.11 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.812 0.815 . . . . 0.0 108.935 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.511 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.81 -38.67 35.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.803 -0.561 . . . . 0.0 110.512 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -55.01 -62.51 1.61 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.133 -0.979 . . . . 0.0 109.58 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.695 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -52.85 -39.24 62.39 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.423 -0.798 . . . . 0.0 109.851 179.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.553 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.6 m -57.98 -62.33 1.9 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.334 -0.854 . . . . 0.0 110.452 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.616 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 12.2 mtmt -51.13 -60.03 3.55 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.293 -0.879 . . . . 0.0 109.575 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -46.13 -30.34 1.89 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.258 0.552 . . . . 0.0 110.398 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.414 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 30.7 tpt180 -80.43 -22.81 40.79 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.25 -0.906 . . . . 0.0 108.962 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.56 42.67 0.31 Allowed Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.683 ' CD1' HG12 ' A' ' 44' ' ' VAL . 37.6 m-85 -130.32 169.54 15.32 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.268 -1.136 . . . . 0.0 110.778 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 1.001 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -80.01 -28.05 12.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 CA-C-O 122.206 1.003 . . . . 0.0 108.404 178.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.597 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.88 -159.86 25.89 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.759 -1.337 . . . . 0.0 109.759 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.663 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.04 -173.58 29.84 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.545 HD22 ' HB2' ' A' ' 41' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.513 0 O-C-N 121.301 -1.117 . . . . 0.0 110.692 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.705 ' O ' ' N ' ' A' ' 7' ' ' LYS . 13.5 t . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 121.209 0.528 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.739 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.6 m-30 -105.37 168.82 8.82 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.139 -0.976 . . . . 0.0 109.164 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.802 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.0 m -144.42 119.32 9.95 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.775 -1.203 . . . . 0.0 110.74 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 1.001 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -86.59 138.72 31.46 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.696 0.76 . . . . 0.0 110.433 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.905 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.97 21.77 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 CA-C-O 121.177 0.513 . . . . 0.0 109.834 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.722 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.24 90.1 3.14 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 177.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.729 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.865 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.473 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.421 0.629 . . . . 0.0 110.382 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.901 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.46 158.71 42.99 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.82 . . . . 0.0 111.121 178.974 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.829 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -130.38 138.27 50.29 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.76 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 3.9 mtm -108.65 143.43 37.73 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.04 0.924 . . . . 0.0 111.275 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.765 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -122.38 179.87 2.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.765 ' H ' HD12 ' A' ' 5' ' ' ILE . 4.5 mttt -101.91 107.95 19.26 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 121.598 -0.688 . . . . 0.0 110.403 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.719 ' N ' ' O ' ' A' ' 40' ' ' CYS . 6.3 mmtm -94.74 55.4 1.89 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.079 -1.013 . . . . 0.0 109.625 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -64.26 -24.09 67.54 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.252 0.549 . . . . 0.0 110.174 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.24 -5.71 43.32 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.683 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 40.8 m0 -96.91 -19.9 18.5 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.191 -1.182 . . . . 0.0 110.451 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.492 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.78 142.02 10.1 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -39.02 161.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.592 -0.946 . . . . 0.0 110.311 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.5 t -100.99 151.74 21.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.277 -0.889 . . . . 0.0 110.77 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.824 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -104.98 -32.13 8.89 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.548 -0.72 . . . . 0.0 110.025 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.817 HG22 ' H ' ' A' ' 16' ' ' ASP . 4.3 mt -116.51 -157.79 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.501 -0.75 . . . . 0.0 110.224 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.817 ' H ' HG22 ' A' ' 15' ' ' ILE . 86.7 m-20 -106.39 -14.97 14.94 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.55 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -113.57 -26.55 8.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.681 -0.637 . . . . 0.0 109.782 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.824 HG21 HD21 ' A' ' 14' ' ' LEU . 24.8 m -40.16 -58.12 1.54 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.906 . . . . 0.0 109.244 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.632 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 13.3 t -53.74 -51.56 62.94 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.362 -0.836 . . . . 0.0 109.026 178.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 17' ' ' THR . . . -47.39 -42.78 22.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.843 -0.536 . . . . 0.0 110.866 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.404 ' NE2' ' HB ' ' A' ' 17' ' ' THR . 50.2 m170 -53.88 -62.4 1.68 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.074 -1.016 . . . . 0.0 109.67 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.683 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 75.7 p -51.35 -38.95 55.86 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.764 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.573 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 62.4 m -58.81 -60.94 3.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.8 . . . . 0.0 110.443 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.613 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.03 -61.48 2.13 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.344 -0.847 . . . . 0.0 109.56 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -48.78 -29.94 5.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.265 0.555 . . . . 0.0 110.391 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.52 -20.86 49.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.199 -0.938 . . . . 0.0 108.762 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.64 40.63 0.52 Allowed Glycine 0 N--CA 1.484 1.877 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.613 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 20.5 m-85 -129.42 170.23 13.94 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.239 -1.153 . . . . 0.0 110.889 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.991 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -79.11 -28.59 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.0 -158.83 24.07 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.714 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.57 -165.07 16.65 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.876 -1.289 . . . . 0.0 109.876 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.551 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.473 0 O-C-N 121.297 -1.119 . . . . 0.0 110.932 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.719 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.6 t . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 121.008 0.433 . . . . 0.0 110.593 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.75 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 6.2 m-85 -106.34 165.56 11.17 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.024 -1.047 . . . . 0.0 109.342 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.76 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.0 m -142.17 119.55 11.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.0 110.91 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.991 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.99 138.36 33.15 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.288 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.901 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.91 167.72 19.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 CA-C-O 121.238 0.542 . . . . 0.0 109.891 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.719 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 90.23 3.19 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.899 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.473 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.786 -176.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.485 0.66 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.87 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -162.52 159.02 24.35 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.389 -0.82 . . . . 0.0 111.223 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.849 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.27 138.45 50.5 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.81 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.5 OUTLIER -111.17 146.56 36.65 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 122.139 0.971 . . . . 0.0 111.536 -178.778 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.792 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.77 179.73 2.62 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.662 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.792 ' H ' HD12 ' A' ' 5' ' ' ILE . 1.1 mppt? -101.45 108.42 20.0 Favored 'General case' 0 C--N 1.294 -1.841 0 O-C-N 121.572 -0.705 . . . . 0.0 110.44 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 10.8 mmtm -94.77 55.69 1.92 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.127 -0.983 . . . . 0.0 109.603 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.52 -22.3 66.7 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.202 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.94 -6.44 52.24 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.735 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.94 -24.73 16.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.274 -1.133 . . . . 0.0 110.401 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.92 141.81 6.9 Favored Glycine 0 N--CA 1.487 2.077 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.524 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.09 164.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.489 -1.006 . . . . 0.0 110.372 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 34.6 t -111.07 151.93 27.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.239 -0.913 . . . . 0.0 110.685 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.774 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.27 -31.32 8.68 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.496 -0.753 . . . . 0.0 110.088 179.766 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.774 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.3 mm -117.19 -145.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.475 -0.765 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.598 ' H ' HG22 ' A' ' 15' ' ' ILE . 15.5 m-20 -119.38 -26.43 5.83 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.525 -0.734 . . . . 0.0 109.338 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.5 m -98.74 -32.33 11.44 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.503 -0.748 . . . . 0.0 109.559 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.66 HG21 HD21 ' A' ' 14' ' ' LEU . 94.1 m -40.62 -45.82 2.42 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.36 -0.838 . . . . 0.0 109.236 179.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.608 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 9.1 t -68.53 -48.01 65.44 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.773 0.797 . . . . 0.0 109.14 178.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.506 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -50.64 -36.81 37.23 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.69 -0.631 . . . . 0.0 110.49 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -54.58 -62.72 1.47 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.133 -0.979 . . . . 0.0 109.549 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.735 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.5 m -53.31 -39.66 64.19 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.446 -0.784 . . . . 0.0 109.717 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.56 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.1 m -57.59 -62.1 2.03 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.394 -0.816 . . . . 0.0 110.509 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 24.3 ttpt -49.55 -61.31 2.18 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.33 -0.856 . . . . 0.0 109.469 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 38.0 m-20 -47.47 -29.6 2.83 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.2 0.524 . . . . 0.0 110.499 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -79.25 -20.88 47.08 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.176 -0.952 . . . . 0.0 108.756 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.16 37.79 0.68 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 108.984 -1.646 . . . . 0.0 108.984 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.792 ' CD2' HG12 ' A' ' 44' ' ' VAL . 11.2 m-85 -124.31 168.0 13.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.367 -1.078 . . . . 0.0 110.457 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.971 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -76.7 -28.79 17.65 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 CA-C-O 122.21 1.005 . . . . 0.0 108.31 178.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.591 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 176.99 -159.1 25.32 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.68 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.18 -179.75 36.1 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.558 ' OD1' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -140.39 172.86 12.13 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.331 -1.1 . . . . 0.0 110.721 179.585 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.558 ' N ' ' OD1' ' A' ' 32' ' ' ASN . 59.5 m -129.17 102.33 6.42 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -78.84 120.3 23.26 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.305 -0.872 . . . . 0.0 110.43 -179.152 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.474 ' O ' ' NE ' ' A' ' 38' ' ' ARG . . . -71.55 -36.67 62.43 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.333 -1.507 . . . . 0.0 109.333 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 43.3 ttm -52.35 -35.01 50.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.255 -1.144 . . . . 0.0 110.002 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.443 ' O ' ' C ' ' A' ' 38' ' ' ARG . 36.3 p -128.05 9.45 6.28 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.282 -0.886 . . . . 0.0 110.274 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 34' ' ' LYS . 11.2 mmt180 40.98 55.9 3.05 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.304 -0.873 . . . . 0.0 110.118 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.424 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 1.6 m -122.63 162.04 22.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.264 -0.897 . . . . 0.0 110.499 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 5.8 t -100.61 125.16 46.97 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.413 -0.804 . . . . 0.0 110.954 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.73 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-85 -105.83 167.2 9.94 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 109.548 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.81 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.3 m -143.59 119.51 10.62 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.706 -1.246 . . . . 0.0 110.891 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.971 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.04 140.81 30.73 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.732 0.777 . . . . 0.0 110.633 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.87 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -127.33 166.64 23.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.14 0.495 . . . . 0.0 109.84 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.722 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.27 89.95 3.15 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 177.92 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.424 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.779 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.742 -176.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.401 0.62 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.898 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -157.59 158.36 35.42 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 121.909 0.862 . . . . 0.0 111.329 178.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.831 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.8 m -131.06 139.17 49.87 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.781 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.6 OUTLIER -109.75 145.95 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 122.038 0.923 . . . . 0.0 111.409 -178.829 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.734 HG13 ' N ' ' A' ' 6' ' ' LYS . 0.1 OUTLIER -122.27 179.02 2.65 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.938 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.734 ' N ' HG13 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -98.02 108.44 21.14 Favored 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.462 -179.938 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.696 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -98.27 55.45 1.13 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.119 -0.988 . . . . 0.0 109.661 179.556 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.494 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -67.15 -26.75 66.81 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.319 0.58 . . . . 0.0 110.103 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.494 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -61.78 -12.67 36.06 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.693 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 36.8 m0 -91.98 -17.97 24.36 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.266 -1.138 . . . . 0.0 110.303 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.469 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 108.0 140.04 9.19 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -40.93 163.62 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.591 -0.946 . . . . 0.0 110.122 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 12.8 t -110.22 151.53 27.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.188 -0.945 . . . . 0.0 110.77 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.862 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.71 -31.25 8.97 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.571 -0.706 . . . . 0.0 109.965 179.666 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.862 HD11 HD12 ' A' ' 14' ' ' LEU . 4.0 mm -109.93 -143.56 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.568 -0.708 . . . . 0.0 110.127 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.553 ' H ' HG22 ' A' ' 15' ' ' ILE . 25.8 m-20 -125.69 -20.8 4.58 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.369 -0.832 . . . . 0.0 109.876 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.486 ' O ' ' C ' ' A' ' 18' ' ' THR . 1.3 m -105.13 -30.18 9.9 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.34 -0.85 . . . . 0.0 109.752 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.49 ' OG1' ' HB ' ' A' ' 15' ' ' ILE . 1.0 OUTLIER -39.74 -53.99 2.14 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.288 -0.882 . . . . 0.0 109.205 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.593 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.2 t -58.74 -51.53 69.57 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.358 -0.839 . . . . 0.0 109.072 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.539 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.39 -41.21 19.44 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.804 -0.56 . . . . 0.0 110.804 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -54.29 -61.71 2.13 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.103 -0.998 . . . . 0.0 109.766 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.693 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -53.74 -37.53 63.45 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.398 -0.814 . . . . 0.0 110.03 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.577 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 63.6 m -58.43 -61.88 2.26 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.341 -0.85 . . . . 0.0 110.635 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.646 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 6.0 mtpt -50.69 -60.68 2.8 Favored 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.305 -0.872 . . . . 0.0 109.6 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -47.16 -29.69 2.45 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.182 0.515 . . . . 0.0 110.472 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 26' ' ' ARG . 0.3 OUTLIER -79.6 -23.49 42.66 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.256 -0.903 . . . . 0.0 108.815 179.42 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.25 41.15 0.37 Allowed Glycine 0 N--CA 1.484 1.846 0 N-CA-C 108.933 -1.667 . . . . 0.0 108.933 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.716 ' CD1' HG12 ' A' ' 44' ' ' VAL . 27.7 m-85 -129.44 169.2 15.23 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.276 -1.132 . . . . 0.0 110.592 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.969 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.99 -28.3 13.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 CA-C-O 122.19 0.995 . . . . 0.0 108.371 179.025 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.91 -158.57 23.69 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.712 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.48 -162.22 12.25 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.561 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -153.36 176.64 11.77 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.305 -1.115 . . . . 0.0 111.01 -179.874 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.573 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 78.8 m -136.52 95.14 3.1 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.93 ' HB3' HG22 ' A' ' 37' ' ' THR . 1.4 mmtt -79.31 123.12 27.16 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.131 -0.981 . . . . 0.0 110.716 -178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.406 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -77.44 -34.81 39.05 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.0 mtt -60.84 -38.43 85.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.362 -1.081 . . . . 0.0 109.735 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.93 HG22 ' HB3' ' A' ' 34' ' ' LYS . 8.8 t -116.12 4.51 13.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.358 -0.839 . . . . 0.0 109.977 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 34' ' ' LYS . 2.9 mtp180 39.05 56.63 2.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.384 -0.822 . . . . 0.0 110.009 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.617 ' OG1' HG23 ' A' ' 37' ' ' THR . 0.2 OUTLIER -128.07 157.93 39.37 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.285 -0.885 . . . . 0.0 110.654 -179.741 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.696 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t -99.91 116.86 32.95 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.495 -0.753 . . . . 0.0 110.558 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.719 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.5 m-30 -99.45 163.16 12.64 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.001 -1.062 . . . . 0.0 109.649 178.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.781 ' O ' ' HA ' ' A' ' 4' ' ' MET . 83.7 m -140.09 119.09 12.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.816 -1.177 . . . . 0.0 110.763 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.969 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.68 139.91 32.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.537 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.898 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.46 166.79 22.16 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-O 121.207 0.527 . . . . 0.0 109.801 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.729 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.34 90.03 3.19 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 177.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.422 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.723 -176.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.42 0.629 . . . . 0.0 110.375 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.895 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.95 158.09 41.57 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.377 -0.827 . . . . 0.0 111.085 178.882 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.828 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.18 138.8 51.95 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.759 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 18.5 mtm -109.85 146.19 35.5 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.113 0.959 . . . . 0.0 111.484 -178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.747 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -124.28 179.53 2.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.708 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.747 ' H ' HD12 ' A' ' 5' ' ' ILE . 8.0 mttt -101.37 109.23 21.03 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 121.634 -0.666 . . . . 0.0 110.336 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.688 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -93.83 55.24 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.105 -0.997 . . . . 0.0 109.511 179.503 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.554 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.9 OUTLIER -65.49 -28.99 69.59 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-O 121.323 0.582 . . . . 0.0 110.173 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.554 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -63.14 -11.07 37.13 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 37.2 m0 -93.72 -19.38 21.13 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.257 -1.143 . . . . 0.0 110.247 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 105.69 141.35 10.54 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.462 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -38.61 154.89 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.575 -0.956 . . . . 0.0 110.087 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.43 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 31.7 t -94.27 150.06 20.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.144 -0.972 . . . . 0.0 110.58 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.85 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -106.46 -31.2 8.65 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.463 -0.773 . . . . 0.0 110.034 179.729 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.85 HD13 ' C ' ' A' ' 14' ' ' LEU . 2.4 mm -115.15 -155.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.494 -0.754 . . . . 0.0 110.321 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.664 ' H ' HG22 ' A' ' 15' ' ' ILE . 1.0 OUTLIER -107.35 -26.1 11.15 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.334 -0.854 . . . . 0.0 109.688 179.666 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.492 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.3 OUTLIER -104.0 -28.95 11.23 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.457 -0.777 . . . . 0.0 109.638 179.678 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.565 HG21 HD21 ' A' ' 14' ' ' LEU . 3.0 m -39.02 -55.4 1.58 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.376 -0.828 . . . . 0.0 109.358 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.588 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -58.19 -52.28 66.21 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.342 -0.849 . . . . 0.0 108.977 178.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.431 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.87 -42.25 47.32 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.704 -0.622 . . . . 0.0 110.441 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -51.42 -59.05 4.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.229 -0.919 . . . . 0.0 109.709 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.688 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -57.35 -37.42 72.56 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.369 -0.832 . . . . 0.0 109.966 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.545 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.9 m -59.83 -60.06 4.44 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.259 -0.901 . . . . 0.0 110.568 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' O ' ' N ' ' A' ' 27' ' ' GLY . 16.9 mtpt -51.46 -60.76 2.78 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.334 -0.854 . . . . 0.0 109.637 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -43.52 -29.81 0.51 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.147 0.498 . . . . 0.0 110.686 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.571 ' HG2' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -79.79 -28.44 40.28 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.217 -0.927 . . . . 0.0 108.703 179.39 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 129.75 37.57 0.36 Allowed Glycine 0 N--CA 1.484 1.865 0 N-CA-C 108.678 -1.769 . . . . 0.0 108.678 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.571 ' CE2' ' HG2' ' A' ' 26' ' ' ARG . 20.5 m-85 -121.48 168.11 12.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.334 -1.098 . . . . 0.0 110.697 -179.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.935 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.83 -28.12 13.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-O 122.102 0.953 . . . . 0.0 108.564 179.187 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.585 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.66 -160.3 26.8 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.642 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -161.31 172.53 37.56 Favored Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.615 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -128.37 161.93 28.29 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.081 -1.246 . . . . 0.0 111.053 -179.871 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.518 ' SG ' ' HB3' ' A' ' 19' ' ' CYS . 70.1 m -122.71 98.94 6.14 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.522 ' O ' ' N ' ' A' ' 38' ' ' ARG . 11.7 mttt -79.58 118.96 21.9 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.21 -0.931 . . . . 0.0 110.701 -179.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -75.1 -36.69 45.3 Favored Glycine 0 N--CA 1.489 2.195 0 N-CA-C 108.967 -1.653 . . . . 0.0 108.967 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.1 ttp -66.2 -26.4 67.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.342 -1.093 . . . . 0.0 110.09 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.514 ' OG1' ' HB3' ' A' ' 34' ' ' LYS . 7.0 p -119.41 0.04 11.01 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.275 -0.891 . . . . 0.0 110.066 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 34' ' ' LYS . 33.9 mtt180 40.89 54.95 3.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.34 -0.85 . . . . 0.0 110.218 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' A' ' 37' ' ' THR . 2.2 m -135.18 151.56 50.77 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.402 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.688 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.3 t -97.01 129.74 44.43 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.358 -0.839 . . . . 0.0 110.84 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.702 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 8.6 m-85 -109.99 169.27 8.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.12 -0.987 . . . . 0.0 109.133 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.759 ' O ' ' HA ' ' A' ' 4' ' ' MET . 86.2 m -143.99 118.98 9.99 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.701 -1.249 . . . . 0.0 110.725 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.935 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.83 139.04 31.62 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.725 -0.79 . . . . 0.0 110.486 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.895 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.24 23.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.726 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.23 89.82 3.12 Favored 'General case' 0 C--N 1.295 -1.767 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 177.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.431 ' O ' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.766 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.789 -176.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.516 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.487 0.66 . . . . 0.0 110.462 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.899 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.65 159.02 43.21 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.396 -0.815 . . . . 0.0 110.882 178.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.788 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -129.41 138.5 51.52 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.785 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.2 OUTLIER -110.15 142.66 41.35 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-O 122.051 0.929 . . . . 0.0 111.248 -178.888 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.755 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -120.9 178.14 2.86 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.755 ' H ' HD12 ' A' ' 5' ' ' ILE . 8.7 mttp -98.96 108.78 21.55 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.794 -0.566 . . . . 0.0 110.075 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.702 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.7 OUTLIER -98.1 55.68 1.17 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.118 -0.989 . . . . 0.0 109.873 179.764 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -21.3 64.72 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.279 0.561 . . . . 0.0 110.071 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.54 -6.84 51.43 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.744 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.281 -1.129 . . . . 0.0 110.215 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 108.77 140.68 9.18 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 109.439 -1.465 . . . . 0.0 109.439 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.29 155.63 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.458 -1.025 . . . . 0.0 110.173 -179.872 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.467 ' N ' ' O ' ' A' ' 38' ' ' ARG . 35.5 t -100.22 153.28 19.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.173 -0.955 . . . . 0.0 110.762 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.794 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -107.35 -31.41 8.2 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.562 -0.711 . . . . 0.0 109.985 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.794 HD11 HD12 ' A' ' 14' ' ' LEU . 2.9 mm -117.37 -150.8 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.487 -0.758 . . . . 0.0 110.274 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.62 ' H ' HG22 ' A' ' 15' ' ' ILE . 4.5 m-20 -113.44 -26.13 8.47 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.443 -0.785 . . . . 0.0 109.427 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.469 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -99.21 -29.76 12.65 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.5 -0.75 . . . . 0.0 109.487 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.654 HG21 HD21 ' A' ' 14' ' ' LEU . 90.0 m -40.38 -49.72 2.82 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.38 -0.825 . . . . 0.0 109.276 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.7 t -64.31 -50.53 67.45 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.345 -0.847 . . . . 0.0 109.073 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.512 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.81 -39.64 18.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.734 -0.604 . . . . 0.0 110.662 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 10.2 m170 -53.03 -61.34 2.36 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.212 -0.93 . . . . 0.0 109.677 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.744 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.8 m -55.84 -38.75 70.47 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.459 -0.776 . . . . 0.0 109.87 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.54 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 60.3 m -58.8 -61.86 2.3 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.331 -0.856 . . . . 0.0 110.313 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.5 OUTLIER -50.66 -61.17 2.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.386 -0.821 . . . . 0.0 109.628 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -51.16 -27.6 9.04 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.15 0.5 . . . . 0.0 110.502 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 22' ' ' SER . 1.4 tpt180 -78.52 -22.43 47.36 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.2 -0.938 . . . . 0.0 108.677 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.36 38.54 0.51 Allowed Glycine 0 N--CA 1.484 1.871 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.635 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.2 m-85 -128.56 170.9 12.66 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.258 -1.142 . . . . 0.0 110.641 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.992 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.87 -28.32 15.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 CA-C-O 122.199 1.0 . . . . 0.0 108.433 179.197 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.588 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.0 -157.74 22.97 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.719 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.54 -166.2 18.87 Favored Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.57 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -154.58 177.15 11.53 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.292 -1.122 . . . . 0.0 110.686 179.947 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.54 ' N ' ' CG ' ' A' ' 32' ' ' ASN . 60.9 m -138.22 119.65 14.85 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 38' ' ' ARG . 22.0 tttt -79.06 167.55 20.9 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.176 -0.952 . . . . 0.0 110.554 -179.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -108.83 -30.04 3.87 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.347 -1.501 . . . . 0.0 109.347 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.7 mtt -68.15 -23.6 64.9 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.226 -1.161 . . . . 0.0 110.027 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.42 ' O ' ' C ' ' A' ' 38' ' ' ARG . 0.7 OUTLIER -143.68 9.76 1.58 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.309 -0.869 . . . . 0.0 110.186 179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.579 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 0.3 OUTLIER 41.46 53.65 3.7 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.33 -0.856 . . . . 0.0 110.164 -179.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.745 HG22 ' H ' ' A' ' 40' ' ' CYS . 2.2 m -95.84 -168.83 1.83 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.237 -0.914 . . . . 0.0 110.335 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.745 ' H ' HG22 ' A' ' 39' ' ' THR . 2.5 t -133.25 123.49 25.64 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.394 -0.816 . . . . 0.0 110.544 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.746 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.9 m-85 -108.5 166.65 10.62 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.009 -1.057 . . . . 0.0 109.515 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.785 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.16 120.15 12.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.774 -1.204 . . . . 0.0 110.713 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.992 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.68 137.61 32.71 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.462 -179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.899 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.97 166.47 22.02 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.177 0.513 . . . . 0.0 109.774 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.707 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.19 90.58 3.12 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.516 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.756 -176.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.52 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.413 0.625 . . . . 0.0 110.418 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.93 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -150.04 158.08 43.8 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 119.519 -0.872 . . . . 0.0 111.073 178.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.798 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -128.59 138.71 52.35 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.796 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -110.04 143.06 40.6 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 122.064 0.935 . . . . 0.0 111.569 -178.784 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.788 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -120.54 -179.85 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.795 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.788 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -103.06 110.59 22.57 Favored 'General case' 0 C--N 1.296 -1.736 0 O-C-N 121.744 -0.598 . . . . 0.0 110.418 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.644 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.3 OUTLIER -100.69 54.81 0.87 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.044 -1.035 . . . . 0.0 109.692 179.428 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -23.6 67.41 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.285 0.564 . . . . 0.0 110.058 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.96 -7.71 44.79 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.688 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.8 m0 -95.47 -19.52 19.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.252 -1.146 . . . . 0.0 110.295 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 106.93 140.86 9.87 Favored Glycine 0 N--CA 1.488 2.125 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.507 ' CD ' ' N ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -39.28 160.65 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.51 -0.994 . . . . 0.0 110.282 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 14.1 t -103.05 152.82 20.92 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.242 -0.911 . . . . 0.0 110.597 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.771 ' C ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.61 -30.89 9.21 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 110.064 179.827 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.771 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.5 mm -116.77 -148.41 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.525 -0.734 . . . . 0.0 110.283 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.635 ' H ' HG22 ' A' ' 15' ' ' ILE . 8.9 m-20 -114.58 -25.81 8.17 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.465 -0.772 . . . . 0.0 109.396 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.49 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -101.92 -29.85 11.58 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.463 -0.773 . . . . 0.0 109.705 179.565 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.624 HG21 HD21 ' A' ' 14' ' ' LEU . 4.4 m -39.42 -53.4 2.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.385 -0.822 . . . . 0.0 109.294 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.575 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 5.5 t -60.24 -46.14 90.83 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.376 -0.827 . . . . 0.0 109.038 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.502 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.53 -39.52 64.73 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.689 -0.632 . . . . 0.0 110.362 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.56 -59.21 4.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.174 -0.954 . . . . 0.0 109.617 179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.688 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 9.0 t -58.44 -36.66 73.99 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.432 -0.792 . . . . 0.0 110.033 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.545 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 70.0 m -61.35 -60.86 3.07 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.316 -0.865 . . . . 0.0 110.443 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.593 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -52.56 -59.61 4.24 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.411 -0.806 . . . . 0.0 109.808 -179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -44.17 -30.06 0.72 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.228 0.537 . . . . 0.0 110.504 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 3.1 ttm-85 -79.72 -28.85 40.51 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.163 -0.961 . . . . 0.0 108.798 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 132.07 39.21 0.24 Allowed Glycine 0 N--CA 1.483 1.825 0 N-CA-C 108.755 -1.738 . . . . 0.0 108.755 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.593 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 22.1 m-85 -125.23 170.09 11.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.375 -1.074 . . . . 0.0 110.692 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.936 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -79.56 -28.47 13.01 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.117 0.96 . . . . 0.0 108.502 179.124 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.579 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.27 -158.59 24.22 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.678 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -160.77 172.48 37.11 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.612 ' OD1' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -124.18 162.15 24.23 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.181 -1.188 . . . . 0.0 110.879 -179.855 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.537 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 78.3 m -122.84 96.51 5.05 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.486 ' HB3' ' OG1' ' A' ' 37' ' ' THR . 0.8 OUTLIER -79.4 130.26 35.25 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.209 -0.932 . . . . 0.0 110.614 -179.214 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.547 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -85.55 -40.87 7.57 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -33.74 75.35 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -1.136 . . . . 0.0 109.762 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.486 ' OG1' ' HB3' ' A' ' 34' ' ' LYS . 30.1 p -111.02 -1.2 16.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.368 -0.833 . . . . 0.0 110.051 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.547 ' HG2' ' O ' ' A' ' 35' ' ' GLY . 1.3 mtm-85 40.15 55.4 2.69 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.863 . . . . 0.0 110.055 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' A' ' 37' ' ' THR . 0.4 OUTLIER -133.07 153.61 51.34 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.26 -0.9 . . . . 0.0 110.409 -179.81 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.644 ' O ' ' N ' ' A' ' 7' ' ' LYS . 3.1 t -98.92 127.42 44.84 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.526 -0.733 . . . . 0.0 110.76 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.739 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.3 m-85 -107.62 168.87 8.95 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.067 -1.02 . . . . 0.0 108.714 178.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.796 ' O ' ' HA ' ' A' ' 4' ' ' MET . 78.1 m -141.0 119.69 12.48 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 120.703 -1.248 . . . . 0.0 111.053 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.936 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.34 136.6 33.41 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-O 121.745 0.783 . . . . 0.0 110.224 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.93 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.0 165.62 23.57 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.703 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -75.84 90.65 2.93 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 106.606 -1.627 . . . . 0.0 106.606 177.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.52 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.752 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.791 -176.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.482 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.403 0.621 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.846 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -158.03 159.66 36.61 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.339 -0.85 . . . . 0.0 111.308 179.129 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.791 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.4 m -129.07 139.28 52.08 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.794 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -110.13 146.36 35.61 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.012 0.911 . . . . 0.0 111.609 -178.621 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.781 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -121.99 179.59 2.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.781 ' H ' HD12 ' A' ' 5' ' ' ILE . 6.3 mttp -100.63 108.97 21.0 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.74 -0.6 . . . . 0.0 110.597 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.697 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -95.37 56.0 1.8 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.092 -1.005 . . . . 0.0 109.592 179.316 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -69.65 -18.66 63.6 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.4 179.989 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.475 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -77.93 -0.79 76.83 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.726 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 42.1 m0 -100.84 -15.47 17.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.213 -1.169 . . . . 0.0 110.251 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.89 141.44 9.8 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.3 165.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.461 -1.023 . . . . 0.0 110.19 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 12.3 t -107.84 153.75 22.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.135 -0.978 . . . . 0.0 110.89 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.773 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -108.33 -30.74 8.17 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 121.556 0.693 . . . . 0.0 110.006 179.61 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.721 HD13 ' C ' ' A' ' 14' ' ' LEU . 3.6 mm -119.52 -147.92 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.556 -0.715 . . . . 0.0 110.351 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.613 ' H ' HG22 ' A' ' 15' ' ' ILE . 21.1 m-20 -116.12 -25.6 7.56 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.43 -0.794 . . . . 0.0 109.372 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.473 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.64 -30.0 12.72 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.472 -0.767 . . . . 0.0 109.536 179.328 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.773 HG21 HD21 ' A' ' 14' ' ' LEU . 44.9 m -41.05 -54.59 2.77 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.327 -0.858 . . . . 0.0 109.339 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.621 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 11.0 t -60.23 -49.99 75.42 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.306 -0.871 . . . . 0.0 109.076 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.488 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.65 -41.55 43.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.739 -0.601 . . . . 0.0 110.715 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -51.51 -59.83 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.114 -0.991 . . . . 0.0 109.714 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.726 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 19.5 m -56.35 -37.48 70.07 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.405 -0.809 . . . . 0.0 109.817 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.542 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.0 m -59.32 -61.99 2.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.431 -0.793 . . . . 0.0 110.526 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 7.8 mtpt -50.25 -60.22 3.19 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.418 -0.801 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.05 -30.0 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.312 0.577 . . . . 0.0 110.139 179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.41 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 36.8 tpt85 -78.58 -21.38 48.72 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.333 -0.855 . . . . 0.0 108.822 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 122.03 40.81 0.5 Allowed Glycine 0 N--CA 1.484 1.837 0 N-CA-C 108.932 -1.667 . . . . 0.0 108.932 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.622 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.8 m-85 -128.81 169.53 14.45 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -1.083 . . . . 0.0 110.654 -179.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.905 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -78.58 -28.82 14.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 178.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.566 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.43 -157.33 21.1 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.693 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.23 -165.86 17.93 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.628 -1.389 . . . . 0.0 109.628 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.569 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -151.7 175.74 12.08 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.185 -1.185 . . . . 0.0 110.953 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 39' ' ' THR . 60.0 m -138.11 116.25 11.76 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.489 ' O ' ' HA ' ' A' ' 38' ' ' ARG . 11.0 mmmm -78.94 178.82 7.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.171 -0.956 . . . . 0.0 110.511 -179.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.495 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -117.39 -51.89 0.34 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.9 mtt -53.97 -33.37 56.74 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.298 -1.119 . . . . 0.0 109.964 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.561 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.1 t -125.0 0.4 7.93 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.356 -0.84 . . . . 0.0 110.156 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.554 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 0.8 OUTLIER 41.13 54.82 3.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.296 -0.877 . . . . 0.0 110.251 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.68 HG22 ' H ' ' A' ' 40' ' ' CYS . 3.1 m -100.85 -176.32 3.14 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.291 -0.881 . . . . 0.0 110.35 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.697 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.9 t -123.81 126.16 45.97 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.282 -0.886 . . . . 0.0 110.749 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.682 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 4.6 m-85 -110.17 167.1 10.44 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.1 -1.0 . . . . 0.0 109.352 178.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.794 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.9 m -141.6 119.34 11.78 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.648 -1.282 . . . . 0.0 110.834 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.905 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -86.21 139.96 30.57 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 119.745 -0.782 . . . . 0.0 110.793 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.846 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.53 166.89 22.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 CA-C-O 121.181 0.515 . . . . 0.0 109.707 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.709 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 90.35 3.19 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 177.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.786 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.415 0.626 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.892 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -160.49 158.6 29.58 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.832 0.825 . . . . 0.0 111.222 178.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.809 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.32 138.38 51.54 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.786 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.9 OUTLIER -110.17 141.26 43.33 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-O 122.091 0.948 . . . . 0.0 111.272 -178.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.778 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -119.87 179.44 2.04 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 179.798 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.778 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -102.48 105.39 15.93 Favored 'General case' 0 C--N 1.294 -1.81 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.706 ' N ' ' O ' ' A' ' 40' ' ' CYS . 43.3 mmtt -92.05 56.47 2.87 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.968 -1.082 . . . . 0.0 109.561 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.7 OUTLIER -64.93 -24.88 67.66 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.169 179.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.475 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -67.24 -7.9 47.53 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.738 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.2 m0 -94.78 -17.27 22.3 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.22 -1.165 . . . . 0.0 110.335 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.409 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.65 140.59 8.2 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.4 OUTLIER -44.84 157.35 0.07 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.431 -1.041 . . . . 0.0 109.836 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.47 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 18.0 t -105.59 152.35 23.2 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.115 -0.99 . . . . 0.0 111.087 -179.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 1.042 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -111.92 -30.59 7.22 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 121.553 0.692 . . . . 0.0 109.934 179.471 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 1.042 HD11 HD12 ' A' ' 14' ' ' LEU . 1.5 mm -107.2 -148.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.502 -0.749 . . . . 0.0 110.466 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.545 ' H ' HG22 ' A' ' 15' ' ' ILE . 2.9 m-20 -122.55 -25.24 4.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.383 -0.823 . . . . 0.0 109.677 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.482 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.0 OUTLIER -103.07 -29.89 11.08 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.4 -0.812 . . . . 0.0 109.512 179.505 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.482 ' C ' ' O ' ' A' ' 17' ' ' THR . 18.4 m -40.59 -47.4 2.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.302 -0.874 . . . . 0.0 109.092 179.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.629 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.2 t -66.9 -50.33 62.78 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-O 121.793 0.806 . . . . 0.0 109.112 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.476 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -48.17 -39.83 22.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.704 -0.623 . . . . 0.0 110.519 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.407 ' C ' ' CD2' ' A' ' 21' ' ' HIS . 3.7 t-160 -54.37 -61.74 2.11 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.194 -0.942 . . . . 0.0 109.595 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.738 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.3 m -52.81 -39.16 62.14 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.371 -0.831 . . . . 0.0 109.74 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.53 ' SG ' ' HA3' ' A' ' 31' ' ' GLY . 57.7 m -57.6 -62.05 2.06 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.662 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.576 ' O ' ' N ' ' A' ' 27' ' ' GLY . 9.5 mtpt -49.39 -61.02 2.33 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.383 -0.823 . . . . 0.0 109.278 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.1 m-20 -45.79 -31.41 2.04 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.189 0.519 . . . . 0.0 110.347 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -20.65 48.45 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.265 -0.897 . . . . 0.0 108.814 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.576 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 120.21 40.85 0.57 Allowed Glycine 0 N--CA 1.484 1.856 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.626 ' CD1' HG12 ' A' ' 44' ' ' VAL . 34.8 m-85 -126.59 168.47 14.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.37 -1.077 . . . . 0.0 110.696 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.988 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.56 -28.44 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 CA-C-O 122.141 0.972 . . . . 0.0 108.553 179.196 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.603 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.99 -159.2 24.72 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.787 -1.325 . . . . 0.0 109.787 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.713 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.65 -162.52 12.61 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.578 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -158.64 175.42 13.66 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.235 -1.156 . . . . 0.0 110.893 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 39' ' ' THR . 58.4 m -133.18 116.8 16.68 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.81 ' HB3' HG22 ' A' ' 37' ' ' THR . 2.0 mmtt -79.17 169.32 18.33 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.158 -0.964 . . . . 0.0 110.832 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.475 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -111.48 -49.22 0.66 Allowed Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.199 -1.561 . . . . 0.0 109.199 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.1 mmt -63.22 -25.11 68.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.243 -1.151 . . . . 0.0 109.78 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.81 HG22 ' HB3' ' A' ' 34' ' ' LYS . 11.2 t -124.03 -6.11 7.86 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.415 -0.803 . . . . 0.0 110.087 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.548 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER 41.87 56.02 3.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 109.88 -179.99 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.511 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 10.5 m -115.12 172.41 7.08 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.364 -0.835 . . . . 0.0 110.322 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.706 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.3 t -109.22 124.98 51.75 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.435 -0.791 . . . . 0.0 110.871 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.749 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 11.4 m-85 -106.86 169.94 8.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.116 -0.99 . . . . 0.0 109.395 178.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.786 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.5 m -146.6 119.02 8.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.645 -1.285 . . . . 0.0 110.924 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.988 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -84.9 138.5 32.48 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.652 0.739 . . . . 0.0 110.364 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.892 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.73 166.68 22.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-O 121.136 0.493 . . . . 0.0 109.796 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.725 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.21 89.72 3.11 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 177.815 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.44 ' OXT' ' SG ' ' A' ' 46' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.753 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.796 -176.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.44 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.3 ttp180 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.365 0.602 . . . . 0.0 110.381 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.921 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -151.85 157.8 42.38 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.232 178.969 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.845 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -129.82 139.1 51.3 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.825 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.99 144.5 41.22 Favored 'General case' 0 C--N 1.29 -2.016 0 CA-C-O 122.097 0.951 . . . . 0.0 111.589 -178.727 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.769 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.32 179.36 2.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.704 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.769 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -97.63 112.03 24.07 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.556 -0.715 . . . . 0.0 110.456 -179.918 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.665 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -94.3 54.69 1.9 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.075 -1.016 . . . . 0.0 109.699 179.606 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.45 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.1 OUTLIER -70.28 -26.73 63.94 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-O 121.36 0.6 . . . . 0.0 110.1 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.45 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -65.19 -9.84 44.13 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.731 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.6 m0 -95.06 -16.72 22.46 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.338 -1.095 . . . . 0.0 110.337 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.504 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 110.73 141.81 8.92 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.504 ' C ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -34.23 151.45 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.646 -0.914 . . . . 0.0 110.304 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 15' ' ' ILE . 17.9 t -95.69 152.19 18.68 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.302 -0.874 . . . . 0.0 110.706 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.985 ' O ' HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -115.05 -31.7 5.96 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.521 -0.737 . . . . 0.0 110.731 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.985 HD13 ' O ' ' A' ' 14' ' ' LEU . 3.4 mm -128.22 169.18 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.217 -0.927 . . . . 0.0 111.065 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.594 ' HA ' ' HB2' ' A' ' 33' ' ' CYS . 20.7 m-20 -75.22 -21.21 58.81 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.444 -0.785 . . . . 0.0 110.453 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.471 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.1 OUTLIER -106.62 -39.97 5.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.197 -0.939 . . . . 0.0 109.643 179.781 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.618 HG21 HD11 ' A' ' 14' ' ' LEU . 99.0 m -41.24 -39.05 1.25 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.273 -0.892 . . . . 0.0 108.654 179.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.572 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 6.2 t -71.54 -49.35 41.56 Favored 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.476 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -53.95 -35.94 62.3 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.749 -0.594 . . . . 0.0 110.307 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -53.6 -61.84 2.04 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.253 -0.905 . . . . 0.0 109.328 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.731 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 14.5 m -54.94 -41.94 71.67 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.41 -0.806 . . . . 0.0 109.505 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.546 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 59.4 m -56.29 -61.87 2.1 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.319 -0.863 . . . . 0.0 110.413 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 15.8 mtmt -50.1 -61.12 2.34 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.418 -0.801 . . . . 0.0 109.629 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -47.35 -29.52 2.61 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-O 121.211 0.529 . . . . 0.0 110.504 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -22.05 45.15 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.216 -0.928 . . . . 0.0 108.846 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 123.32 37.88 0.58 Allowed Glycine 0 N--CA 1.484 1.886 0 N-CA-C 108.802 -1.719 . . . . 0.0 108.802 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.768 ' CD2' HG12 ' A' ' 44' ' ' VAL . 6.8 m-85 -123.74 169.69 11.26 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -1.076 . . . . 0.0 110.463 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.999 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -80.45 -28.08 11.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 CA-C-O 122.202 1.001 . . . . 0.0 108.343 178.88 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.576 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.93 -159.46 24.42 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.64 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.41 172.36 36.8 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.612 ' C ' ' OD1' ' A' ' 32' ' ' ASN . 0.2 OUTLIER -129.68 162.82 27.47 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.016 -1.285 . . . . 0.0 111.458 -179.373 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.594 ' HB2' ' HA ' ' A' ' 16' ' ' ASP . 1.4 t -112.8 97.74 6.75 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.537 ' O ' ' CA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -79.71 117.51 20.67 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.055 -1.028 . . . . 0.0 110.495 -179.487 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.461 ' O ' ' C ' ' A' ' 36' ' ' MET . . . -76.06 -44.81 17.51 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.461 ' C ' ' O ' ' A' ' 35' ' ' GLY . 0.3 OUTLIER -40.85 -43.62 2.09 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.319 -1.107 . . . . 0.0 109.923 179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.478 HG23 ' OG1' ' A' ' 39' ' ' THR . 1.7 t -124.16 9.39 8.63 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.345 -0.847 . . . . 0.0 109.926 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.537 ' CA ' ' O ' ' A' ' 34' ' ' LYS . 0.9 OUTLIER 45.34 52.26 8.97 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.354 -0.841 . . . . 0.0 110.083 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.478 ' OG1' HG23 ' A' ' 37' ' ' THR . 1.3 m -119.19 151.1 38.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.257 -0.902 . . . . 0.0 110.375 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.665 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.2 t -93.76 132.69 37.9 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.469 -0.77 . . . . 0.0 111.053 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.692 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.2 m-30 -110.72 168.75 9.24 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 108.762 178.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.825 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -142.0 118.54 10.96 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 120.717 -1.239 . . . . 0.0 110.776 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.999 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -85.24 137.89 32.7 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.218 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.921 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.88 166.63 21.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.649 0 CA-C-O 121.139 0.495 . . . . 0.0 109.799 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.74 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.26 89.76 3.14 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.756 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.774 -176.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.42 ' C ' ' OG1' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.458 0.647 . . . . 0.0 110.442 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.852 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -167.53 159.28 12.05 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.792 0.806 . . . . 0.0 111.231 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.837 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.42 139.09 50.61 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 177.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.777 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 46.4 mtm -108.01 143.75 36.27 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-O 122.12 0.962 . . . . 0.0 111.548 -178.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.77 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -118.49 179.09 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.679 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.645 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.77 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -101.15 107.92 19.46 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.656 -0.652 . . . . 0.0 110.365 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.69 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -95.11 55.7 1.83 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.128 -0.982 . . . . 0.0 109.523 179.408 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.37 -17.19 64.18 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.256 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -76.24 -4.3 78.65 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.743 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 40.4 m0 -97.55 -24.71 15.43 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.389 -1.065 . . . . 0.0 110.337 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 117.34 142.0 7.08 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.55 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -40.59 163.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.503 -0.998 . . . . 0.0 110.281 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.494 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 49.1 t -105.43 151.87 23.69 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.189 -0.945 . . . . 0.0 110.788 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.971 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -107.35 -31.57 8.13 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.468 -0.77 . . . . 0.0 109.972 179.59 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.702 HD13 ' C ' ' A' ' 14' ' ' LEU . 4.2 mm -120.87 -147.23 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.517 -0.739 . . . . 0.0 110.26 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.632 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.9 OUTLIER -114.38 -26.66 7.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.437 -0.79 . . . . 0.0 109.241 179.387 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.449 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -98.68 -30.97 12.15 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.487 -0.758 . . . . 0.0 109.577 179.534 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.971 HG21 HD21 ' A' ' 14' ' ' LEU . 25.8 m -40.83 -47.96 3.0 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.381 -0.824 . . . . 0.0 109.29 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.598 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 12.3 t -67.33 -48.59 67.1 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.376 -0.827 . . . . 0.0 109.117 178.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.502 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.53 -38.51 54.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.692 -0.63 . . . . 0.0 110.534 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.09 -59.98 3.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.165 -0.959 . . . . 0.0 109.622 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.743 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 17.8 m -57.58 -38.87 75.58 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.382 -0.824 . . . . 0.0 109.706 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.558 ' SG ' ' HA3' ' A' ' 31' ' ' GLY . 60.5 m -60.13 -61.6 2.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.386 -0.821 . . . . 0.0 110.219 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.638 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.96 -61.0 2.49 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.607 179.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -51.04 -27.94 9.11 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-O 121.175 0.512 . . . . 0.0 110.601 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 22' ' ' SER . 13.4 tpt180 -78.04 -23.39 48.16 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.189 -0.944 . . . . 0.0 108.782 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 125.71 35.68 0.59 Allowed Glycine 0 N--CA 1.485 1.914 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.638 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.4 m-85 -125.15 170.5 11.16 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -1.115 . . . . 0.0 110.752 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.937 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.01 -28.66 19.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-O 122.234 1.016 . . . . 0.0 108.298 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 175.99 -157.62 23.77 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.71 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.61 173.76 37.19 Favored Glycine 0 N--CA 1.488 2.111 0 C-N-CA 119.696 -1.24 . . . . 0.0 110.006 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.563 ' OD1' ' N ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -135.06 172.75 12.56 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.389 -1.065 . . . . 0.0 110.667 179.706 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.563 ' N ' ' OD1' ' A' ' 32' ' ' ASN . 56.2 m -127.79 115.69 19.04 Favored 'General case' 0 C--N 1.292 -1.891 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.221 179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.675 ' HB3' HG22 ' A' ' 37' ' ' THR . 0.7 OUTLIER -79.13 129.15 34.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.153 -0.967 . . . . 0.0 110.381 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -80.4 -32.58 34.12 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.39 -26.54 65.61 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.256 -1.143 . . . . 0.0 110.267 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.675 HG22 ' HB3' ' A' ' 34' ' ' LYS . 3.9 t -132.41 7.2 4.18 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.22 -0.925 . . . . 0.0 110.324 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.55 ' O ' ' HA ' ' A' ' 12' ' ' LYS . 26.7 mtm180 40.65 55.43 2.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.523 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 1.8 m -116.69 162.06 18.25 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.256 -0.902 . . . . 0.0 110.205 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.69 ' O ' ' N ' ' A' ' 7' ' ' LYS . 7.9 t -100.04 124.56 45.54 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.296 -0.877 . . . . 0.0 111.131 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.728 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.0 m-85 -107.09 166.38 10.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.159 -0.963 . . . . 0.0 109.322 178.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.777 ' O ' ' HA ' ' A' ' 4' ' ' MET . 70.0 m -141.01 119.37 12.19 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.671 -1.268 . . . . 0.0 111.012 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.937 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.41 138.48 33.47 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.796 0.808 . . . . 0.0 110.539 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.852 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.18 166.14 22.93 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.727 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.13 89.87 3.07 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 106.826 -1.546 . . . . 0.0 106.826 178.123 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.434 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.774 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.861 -176.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.435 0.636 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.898 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -154.89 158.64 39.63 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.348 -0.845 . . . . 0.0 111.106 178.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.846 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.7 m -130.33 138.06 50.24 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.656 0.741 . . . . 0.0 109.028 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.712 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.8 OUTLIER -107.55 143.51 35.86 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 122.003 0.906 . . . . 0.0 111.209 -179.159 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.78 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -122.56 178.05 3.37 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.78 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.1 OUTLIER -97.43 109.47 22.22 Favored 'General case' 0 C--N 1.296 -1.738 0 O-C-N 121.803 -0.561 . . . . 0.0 110.436 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.699 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -97.51 55.73 1.26 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.121 -0.987 . . . . 0.0 109.571 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.501 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.6 OUTLIER -68.54 -20.28 64.54 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.434 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.501 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -75.47 0.96 59.01 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.7 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 41.2 m0 -102.8 -17.78 15.42 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -1.146 . . . . 0.0 110.336 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 12' ' ' LYS . . . 111.14 140.77 8.41 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.236 -1.546 . . . . 0.0 109.236 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.547 ' O ' ' CD ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -43.7 162.51 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.422 -1.046 . . . . 0.0 110.447 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.444 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 34.5 t -108.6 148.0 30.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.275 -0.891 . . . . 0.0 110.396 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.904 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -105.88 -32.57 8.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.4 -0.813 . . . . 0.0 110.392 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.904 HD11 HD12 ' A' ' 14' ' ' LEU . 4.0 mm -109.18 -146.57 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.366 -0.834 . . . . 0.0 110.373 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.611 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -117.59 -25.0 7.06 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.447 -0.783 . . . . 0.0 109.353 179.497 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.451 ' O ' ' C ' ' A' ' 18' ' ' THR . 2.4 m -103.28 -24.2 13.54 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.539 -0.726 . . . . 0.0 109.441 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.451 ' C ' ' O ' ' A' ' 17' ' ' THR . 24.8 m -40.41 -52.26 2.76 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.442 -0.786 . . . . 0.0 109.389 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.607 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 24.1 t -64.02 -50.49 68.27 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.289 -0.882 . . . . 0.0 109.136 178.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.454 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -46.21 -40.3 11.12 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.729 -0.607 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -53.11 -60.64 3.03 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.198 -0.939 . . . . 0.0 109.828 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.7 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.6 t -56.98 -37.19 71.25 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.416 -0.803 . . . . 0.0 110.088 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 57.8 m -59.47 -62.07 2.15 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.253 -0.904 . . . . 0.0 110.319 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 25.4 tttt -50.84 -60.63 2.87 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 109.626 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -46.66 -30.54 2.39 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.215 0.531 . . . . 0.0 110.551 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -79.11 -23.1 44.31 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.221 -0.925 . . . . 0.0 108.705 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.16 37.77 0.55 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.987 -1.645 . . . . 0.0 108.987 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.772 ' CD2' HG12 ' A' ' 44' ' ' VAL . 9.0 m-85 -122.61 168.62 11.94 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.348 -1.089 . . . . 0.0 110.601 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.935 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -78.51 -28.19 14.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.469 0 CA-C-O 122.176 0.988 . . . . 0.0 108.603 179.141 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.602 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.04 -159.97 25.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.724 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.8 -172.1 27.64 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.784 -1.198 . . . . 0.0 110.117 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.558 ' CG ' ' N ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -152.5 179.33 8.68 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.382 -1.069 . . . . 0.0 110.578 179.959 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.558 ' N ' ' CG ' ' A' ' 32' ' ' ASN . 24.4 m -127.54 88.69 2.83 Favored 'General case' 0 C--N 1.297 -1.712 0 CA-C-O 121.198 0.523 . . . . 0.0 109.819 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.49 ' O ' ' CB ' ' A' ' 39' ' ' THR . 0.5 OUTLIER -154.66 -133.38 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.24 -0.912 . . . . 0.0 110.471 -179.532 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.98 -84.51 1.6 Allowed Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.149 -1.581 . . . . 0.0 109.149 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.714 ' C ' HG22 ' A' ' 37' ' ' THR . 0.0 OUTLIER -100.42 -32.84 10.62 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.299 -1.118 . . . . 0.0 109.668 179.517 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.714 HG22 ' C ' ' A' ' 36' ' ' MET . 0.1 OUTLIER 163.77 -26.66 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.99 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.534 ' CG ' ' C ' ' A' ' 37' ' ' THR . 46.0 mtp180 -153.52 62.96 0.74 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.596 -0.69 . . . . 0.0 109.605 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.797 HG22 ' H ' ' A' ' 40' ' ' CYS . 2.0 m -112.33 -159.48 0.68 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.338 -0.851 . . . . 0.0 110.233 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.797 ' H ' HG22 ' A' ' 39' ' ' THR . 8.3 t -139.12 114.21 9.48 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.352 -0.843 . . . . 0.0 110.454 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.707 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 14.6 m-85 -103.03 163.16 12.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.005 -1.06 . . . . 0.0 109.432 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.724 ' HA ' ' HA2' ' A' ' 31' ' ' GLY . 82.1 m -139.28 119.69 13.88 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.741 -1.224 . . . . 0.0 110.677 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.935 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -84.52 139.97 31.77 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.211 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.898 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.4 m -127.39 167.07 22.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.627 0 CA-C-O 121.256 0.551 . . . . 0.0 110.032 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.728 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.34 89.69 3.18 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 177.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.421 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.77 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.757 -176.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.421 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.374 0.606 . . . . 0.0 110.406 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.894 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -153.78 158.88 41.57 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.393 -0.817 . . . . 0.0 111.166 178.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.828 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -130.48 138.79 50.44 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.777 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -108.77 143.09 38.37 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 122.033 0.92 . . . . 0.0 111.319 -178.872 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.798 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -119.01 179.52 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.65 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.736 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.798 ' H ' HD12 ' A' ' 5' ' ' ILE . 1.3 mtmp? -102.17 104.51 15.1 Favored 'General case' 0 C--N 1.295 -1.804 0 O-C-N 121.706 -0.621 . . . . 0.0 110.399 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.679 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.3 mmpt? -91.13 56.37 3.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.989 -1.07 . . . . 0.0 109.434 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.485 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -65.73 -25.29 67.23 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.329 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.485 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -68.2 -6.96 49.6 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.719 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 39.4 m0 -95.8 -20.04 19.15 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.303 -1.116 . . . . 0.0 110.365 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.479 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.43 142.13 9.52 Favored Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.393 -1.483 . . . . 0.0 109.393 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -40.7 163.71 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.538 -0.978 . . . . 0.0 110.063 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 49.1 t -94.97 151.55 19.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 110.926 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 1.046 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -111.26 -31.5 7.05 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.476 -0.765 . . . . 0.0 109.965 179.494 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.668 HG22 ' H ' ' A' ' 16' ' ' ASP . 6.2 mm -119.86 -145.65 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 O-C-N 121.513 -0.742 . . . . 0.0 110.075 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.668 ' H ' HG22 ' A' ' 15' ' ' ILE . 40.0 m-20 -116.37 -21.22 9.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.234 -0.916 . . . . 0.0 109.577 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.463 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.2 OUTLIER -109.58 -25.11 10.62 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.482 -0.761 . . . . 0.0 109.46 179.431 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 1.046 HG21 HD21 ' A' ' 14' ' ' LEU . 57.9 m -40.78 -56.78 2.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.478 -0.764 . . . . 0.0 109.309 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.603 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 14.1 t -58.45 -52.64 64.76 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.305 -0.872 . . . . 0.0 109.054 178.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.49 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -47.76 -42.81 26.47 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.715 -0.616 . . . . 0.0 110.609 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -52.71 -60.75 2.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.184 -0.947 . . . . 0.0 109.733 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.719 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 16.5 m -53.02 -37.88 61.87 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.391 -0.818 . . . . 0.0 109.632 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.547 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 58.2 m -60.58 -60.43 3.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.46 -0.775 . . . . 0.0 110.449 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.571 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -49.69 -61.06 2.33 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.366 -0.834 . . . . 0.0 109.59 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -47.69 -31.42 4.66 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-O 121.313 0.577 . . . . 0.0 110.241 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.8 tpt180 -76.46 -21.56 55.73 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.252 -0.905 . . . . 0.0 108.654 179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 119.93 38.99 0.67 Allowed Glycine 0 N--CA 1.483 1.803 0 N-CA-C 108.84 -1.704 . . . . 0.0 108.84 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.638 ' CD1' HG12 ' A' ' 44' ' ' VAL . 37.2 m-85 -124.75 168.32 13.36 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.381 -1.07 . . . . 0.0 110.78 -179.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.955 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.44 -28.83 16.32 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 0 CA-C-O 122.177 0.989 . . . . 0.0 108.443 179.117 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.6 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.39 -159.05 24.93 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.681 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.08 178.93 36.84 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.532 ' OD1' ' N ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -143.19 165.03 28.54 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.302 -1.117 . . . . 0.0 110.976 179.698 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.532 ' N ' ' OD1' ' A' ' 32' ' ' ASN . 26.8 m -109.18 112.63 24.9 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.57 ' O ' ' N ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -79.03 119.42 22.14 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.127 -0.983 . . . . 0.0 110.282 -179.237 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -77.55 -35.72 35.82 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.288 -1.525 . . . . 0.0 109.288 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.4 tmm? -60.53 -19.98 58.81 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.239 -1.153 . . . . 0.0 110.013 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.564 ' CG2' ' HB3' ' A' ' 34' ' ' LYS . 2.6 t -145.77 17.99 1.46 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.324 -0.86 . . . . 0.0 110.293 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.57 ' N ' ' O ' ' A' ' 34' ' ' LYS . 1.8 mtt85 35.49 58.91 0.83 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.439 -0.788 . . . . 0.0 110.15 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.1 m -123.47 162.57 22.6 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.319 -0.863 . . . . 0.0 110.635 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.679 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.8 t -98.85 127.34 44.75 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.422 -0.799 . . . . 0.0 110.928 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.725 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 12.1 m-85 -107.67 168.39 9.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.083 -1.011 . . . . 0.0 109.37 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.777 ' O ' ' HA ' ' A' ' 4' ' ' MET . 81.3 m -145.05 118.12 8.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.646 -1.284 . . . . 0.0 110.907 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.955 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.93 139.11 32.8 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.56 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.894 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.2 m -126.84 166.88 22.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 CA-C-O 121.157 0.503 . . . . 0.0 109.695 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.713 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.25 90.19 3.14 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 177.858 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.436 ' H ' ' HA ' ' A' ' 2' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.757 0 CA-C-O 117.963 -1.018 . . . . 0.0 110.694 -176.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 2.8 ttp180 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.398 0.618 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.901 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -147.77 158.64 44.12 Favored 'General case' 0 C--N 1.3 -1.567 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.051 179.061 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.803 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.5 m -129.51 139.58 51.51 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 177.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.799 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 25.8 mtm -108.5 145.63 34.43 Favored 'General case' 0 C--N 1.291 -1.977 0 CA-C-O 122.094 0.949 . . . . 0.0 111.715 -178.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.771 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -121.14 179.8 2.12 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.541 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.771 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -104.25 110.83 23.19 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.584 -0.697 . . . . 0.0 110.355 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.666 ' N ' ' O ' ' A' ' 40' ' ' CYS . 1.7 mmpt? -99.89 54.82 0.93 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.114 -0.991 . . . . 0.0 109.616 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -62.57 -26.06 68.39 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.366 0.603 . . . . 0.0 110.13 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.61 -9.56 45.27 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.712 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.0 m0 -94.07 -22.48 18.48 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.257 -1.143 . . . . 0.0 110.344 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.22 141.15 9.2 Favored Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.521 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -38.73 161.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.627 -0.925 . . . . 0.0 110.392 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 13.1 t -102.32 154.39 19.1 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.243 -0.91 . . . . 0.0 110.623 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.956 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -106.62 -31.13 8.61 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.471 -0.768 . . . . 0.0 110.113 179.79 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.573 HG13 ' HG ' ' A' ' 14' ' ' LEU . 1.8 mt -116.26 -143.66 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.437 -0.789 . . . . 0.0 110.418 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.541 ' H ' HG22 ' A' ' 15' ' ' ILE . 17.9 m-20 -119.89 -15.1 8.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.501 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 31.4 m -113.66 -29.94 6.96 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.715 -0.615 . . . . 0.0 109.778 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.956 HG21 HD21 ' A' ' 14' ' ' LEU . 21.9 m -40.44 -50.44 2.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.373 -0.829 . . . . 0.0 109.254 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.599 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.8 t -61.71 -45.57 93.37 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.861 0.838 . . . . 0.0 108.923 178.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 17' ' ' THR . . . -52.72 -41.83 64.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.753 -0.592 . . . . 0.0 110.789 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 -50.85 -58.53 5.74 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.089 -1.007 . . . . 0.0 109.677 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.712 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 18.8 m -57.84 -36.97 73.03 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.456 -0.778 . . . . 0.0 109.746 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.556 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.5 m -61.57 -60.85 3.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.365 -0.834 . . . . 0.0 110.408 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.657 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 2.0 mmmt -50.64 -60.7 2.77 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.404 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.6 m-20 -47.03 -29.78 2.3 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.274 0.559 . . . . 0.0 110.482 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -79.14 -23.03 44.27 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.213 -0.93 . . . . 0.0 108.778 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.61 35.81 0.63 Allowed Glycine 0 N--CA 1.485 1.916 0 N-CA-C 109.095 -1.602 . . . . 0.0 109.095 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.657 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 23.3 m-85 -123.94 169.49 11.56 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.297 -1.119 . . . . 0.0 110.799 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.826 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.77 -29.31 16.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.871 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.57 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.94 -156.69 19.3 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.727 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -159.78 -169.49 23.15 Favored Glycine 0 N--CA 1.487 2.094 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.546 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -141.41 174.92 10.09 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.277 -1.131 . . . . 0.0 111.003 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.532 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 60.8 m -134.72 98.52 4.07 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 179.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.471 ' HB3' ' OG1' ' A' ' 37' ' ' THR . 0.0 OUTLIER -79.23 125.06 28.97 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.311 -0.868 . . . . 0.0 110.74 -178.973 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.423 ' O ' ' HD3' ' A' ' 38' ' ' ARG . . . -82.95 -34.17 22.09 Favored Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.147 -1.581 . . . . 0.0 109.147 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -69.97 -30.61 68.01 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.316 -1.108 . . . . 0.0 109.858 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.471 ' OG1' ' HB3' ' A' ' 34' ' ' LYS . 2.0 p -117.59 -0.78 11.78 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.344 -0.848 . . . . 0.0 110.123 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.468 ' HA ' ' O ' ' A' ' 34' ' ' LYS . 15.5 mmt180 42.62 54.87 4.4 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.32 -0.862 . . . . 0.0 110.017 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.29 148.03 52.07 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.187 -0.946 . . . . 0.0 110.675 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.666 ' O ' ' N ' ' A' ' 7' ' ' LYS . 4.5 t -92.38 126.05 37.29 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.5 -0.75 . . . . 0.0 110.667 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.697 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 5.5 m-85 -108.44 167.82 9.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.992 . . . . 0.0 109.228 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.799 ' O ' ' HA ' ' A' ' 4' ' ' MET . 79.8 m -140.78 120.49 13.39 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.693 -1.254 . . . . 0.0 111.18 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.826 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.1 OUTLIER -85.33 138.72 32.11 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.463 179.767 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.901 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.98 166.51 21.96 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.72 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.37 90.64 3.23 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 178.048 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.512 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.794 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.814 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.448 ' O ' ' HA ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.252 0.549 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.997 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -149.24 155.85 41.23 Favored 'General case' 0 C--N 1.301 -1.543 0 C-N-CA 119.065 -1.054 . . . . 0.0 111.83 178.819 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.785 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.3 m -130.4 139.75 50.61 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.79 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 20.8 mtm -110.43 149.82 29.74 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-O 122.134 0.969 . . . . 0.0 111.842 -178.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.764 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -126.56 179.51 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.668 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.764 ' H ' HD12 ' A' ' 5' ' ' ILE . 0.5 OUTLIER -101.44 108.5 20.11 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 121.699 -0.626 . . . . 0.0 110.34 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.723 ' N ' ' O ' ' A' ' 40' ' ' CYS . 2.0 mptp? -95.66 55.22 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.162 -0.961 . . . . 0.0 109.652 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.4 OUTLIER -63.52 -32.43 73.88 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 121.313 0.578 . . . . 0.0 110.123 179.832 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.4 ' N ' ' HG2' ' A' ' 8' ' ' GLU . . . -57.77 -15.15 18.06 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.692 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 35.9 m0 -90.64 -25.04 20.31 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.309 -1.112 . . . . 0.0 110.45 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.491 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 113.77 141.77 7.95 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.491 ' O ' ' O ' ' A' ' 11' ' ' GLY . 0.0 OUTLIER -42.32 168.1 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.411 -1.052 . . . . 0.0 110.261 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 22.4 t -121.85 154.14 37.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.215 -0.928 . . . . 0.0 110.628 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.992 HD12 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -114.09 -29.43 6.99 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.507 -0.745 . . . . 0.0 110.428 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.992 HD11 HD12 ' A' ' 14' ' ' LEU . 1.7 mm -104.24 -145.63 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.421 -0.799 . . . . 0.0 110.623 -179.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.553 ' H ' HG22 ' A' ' 15' ' ' ILE . 26.7 m-20 -123.34 -26.4 4.28 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.567 -0.708 . . . . 0.0 109.485 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.548 HG22 ' HD2' ' A' ' 21' ' ' HIS . 0.2 OUTLIER -102.04 -29.72 11.61 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.434 -0.791 . . . . 0.0 109.616 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 17' ' ' THR . 52.8 m -39.98 -45.87 1.97 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.424 -0.797 . . . . 0.0 109.357 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.611 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 10.9 t -73.05 -47.76 41.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.501 -0.749 . . . . 0.0 109.329 179.115 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.492 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -51.45 -43.53 62.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.573 -0.704 . . . . 0.0 110.787 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.548 ' HD2' HG22 ' A' ' 17' ' ' THR . 4.7 m170 -49.69 -58.77 4.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.147 -0.971 . . . . 0.0 109.558 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.692 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 71.5 p -57.57 -37.75 73.68 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.547 -0.721 . . . . 0.0 109.86 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.567 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 67.4 m -60.77 -59.71 4.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.458 -0.776 . . . . 0.0 110.435 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.63 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 14.3 tttp -50.86 -60.35 3.16 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.313 -0.867 . . . . 0.0 109.632 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.9 m-20 -45.95 -30.3 1.73 Allowed 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.281 0.562 . . . . 0.0 110.459 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.468 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 1.1 tpt180 -78.61 -24.09 45.56 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.224 -0.922 . . . . 0.0 108.718 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 124.62 40.23 0.44 Allowed Glycine 0 N--CA 1.483 1.826 0 N-CA-C 108.784 -1.727 . . . . 0.0 108.784 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.65 ' CD1' HG12 ' A' ' 44' ' ' VAL . 27.8 m-85 -127.24 167.86 15.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.386 -1.067 . . . . 0.0 110.624 -179.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.886 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -77.34 -28.88 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 CA-C-O 122.124 0.964 . . . . 0.0 108.531 179.095 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.582 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.46 -156.84 20.1 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.704 ' N ' HD21 ' A' ' 43' ' ' LEU . . . -160.49 -166.53 19.48 Favored Glycine 0 N--CA 1.489 2.174 0 N-CA-C 109.805 -1.318 . . . . 0.0 109.805 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.549 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -146.67 176.41 9.87 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.264 -1.139 . . . . 0.0 110.907 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 15' ' ' ILE . 64.3 m -135.97 97.69 3.69 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.489 ' CG ' ' OG1' ' A' ' 37' ' ' THR . 4.4 tttt -79.51 130.44 35.39 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.131 -0.98 . . . . 0.0 110.436 -179.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.478 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -81.07 -57.22 2.87 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -11.96 20.64 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.194 -1.18 . . . . 0.0 110.05 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.489 ' OG1' ' CG ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -117.93 -14.03 10.04 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.346 -0.846 . . . . 0.0 110.093 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 35' ' ' GLY . 3.4 mtt180 43.74 55.22 5.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.037 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 37' ' ' THR . 2.1 m -139.15 147.38 41.81 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.933 . . . . 0.0 110.5 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.723 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.5 t -92.43 123.57 35.84 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.561 -0.712 . . . . 0.0 110.569 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.732 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 7.7 m-85 -103.66 163.49 12.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.955 -1.091 . . . . 0.0 109.313 178.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.79 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.6 m -138.23 121.09 16.5 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.686 -1.259 . . . . 0.0 111.056 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.886 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -87.63 139.88 30.09 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 119.729 -0.788 . . . . 0.0 110.704 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.997 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.85 167.62 19.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.708 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 91.3 3.24 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 177.906 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.793 -176.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.454 ' HB3' ' O ' ' A' ' 46' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.39 0.614 . . . . 0.0 110.384 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.905 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.47 158.85 43.17 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.21 179.034 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.802 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.4 m -129.39 138.86 51.74 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 177.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.802 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 0.0 OUTLIER -111.83 145.06 40.11 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-O 122.024 0.916 . . . . 0.0 111.404 -178.802 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.788 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -123.36 177.94 3.7 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.788 ' H ' HD12 ' A' ' 5' ' ' ILE . 56.6 mttt -98.65 109.07 21.89 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.795 -0.565 . . . . 0.0 110.161 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.705 ' N ' ' O ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -96.4 55.58 1.49 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.169 -0.957 . . . . 0.0 109.743 179.68 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -66.24 -22.3 66.32 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.094 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.481 ' N ' ' HG3' ' A' ' 8' ' ' GLU . . . -69.15 -10.01 61.42 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.776 -1.33 . . . . 0.0 109.776 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.695 ' CZ3' ' CB ' ' A' ' 22' ' ' SER . 38.9 m0 -93.95 -16.16 24.23 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.189 -1.183 . . . . 0.0 110.274 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.486 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 109.46 140.96 9.04 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.53 ' O ' ' CD ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -40.22 162.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.445 -1.032 . . . . 0.0 110.142 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' ARG . 12.1 t -100.09 155.19 17.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.159 -0.963 . . . . 0.0 110.851 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.651 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -113.61 -30.04 6.95 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.62 -0.675 . . . . 0.0 109.995 179.662 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.602 HG22 ' H ' ' A' ' 16' ' ' ASP . 5.7 mm -120.63 -141.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.615 -0.678 . . . . 0.0 110.202 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.602 ' H ' HG22 ' A' ' 15' ' ' ILE . 94.0 m-20 -124.73 -20.86 4.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.426 -0.796 . . . . 0.0 109.74 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.478 ' O ' ' C ' ' A' ' 18' ' ' THR . 0.9 OUTLIER -107.61 -31.46 8.09 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.37 -0.831 . . . . 0.0 109.572 179.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.651 HG21 HD21 ' A' ' 14' ' ' LEU . 85.0 m -40.77 -50.44 3.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.34 -0.85 . . . . 0.0 109.053 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 15.8 t -61.47 -50.6 72.11 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.812 0.815 . . . . 0.0 108.935 178.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.511 ' HA ' ' N ' ' A' ' 31' ' ' GLY . . . -49.81 -38.67 35.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.803 -0.561 . . . . 0.0 110.512 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -55.01 -62.51 1.61 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.133 -0.979 . . . . 0.0 109.58 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.695 ' CB ' ' CZ3' ' A' ' 10' ' ' TRP . 8.0 t -52.85 -39.24 62.39 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.423 -0.798 . . . . 0.0 109.851 179.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.553 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 61.6 m -57.98 -62.33 1.9 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.334 -0.854 . . . . 0.0 110.452 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.616 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 12.2 mtmt -51.13 -60.03 3.55 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.293 -0.879 . . . . 0.0 109.575 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -46.13 -30.34 1.89 Allowed 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.258 0.552 . . . . 0.0 110.398 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.414 ' HB3' ' O ' ' A' ' 23' ' ' CYS . 30.7 tpt180 -80.43 -22.81 40.79 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.25 -0.906 . . . . 0.0 108.962 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 125.56 42.67 0.31 Allowed Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.683 ' CD1' HG12 ' A' ' 44' ' ' VAL . 37.6 m-85 -130.32 169.54 15.32 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.268 -1.136 . . . . 0.0 110.778 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 1.001 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -80.01 -28.05 12.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 CA-C-O 122.206 1.003 . . . . 0.0 108.404 178.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.597 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 177.88 -159.86 25.89 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.759 -1.337 . . . . 0.0 109.759 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.663 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -161.04 -173.58 29.84 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.545 HD22 ' HB2' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -150.18 176.11 11.15 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.301 -1.117 . . . . 0.0 110.692 179.735 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 39' ' ' THR . 29.9 m -124.28 83.23 2.12 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-O 121.251 0.548 . . . . 0.0 110.012 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.508 ' N ' HD21 ' A' ' 32' ' ' ASN . 13.5 tttm -154.24 173.57 15.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.221 -0.925 . . . . 0.0 110.43 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 137.31 -108.37 0.64 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.361 -1.496 . . . . 0.0 109.361 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.07 -16.61 11.59 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.281 -1.129 . . . . 0.0 109.797 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' A' ' 38' ' ' ARG . 5.2 t -163.97 59.17 0.16 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.453 -0.779 . . . . 0.0 109.675 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 13' ' ' CYS . 10.5 mmt180 59.39 58.11 3.11 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.414 -0.804 . . . . 0.0 109.785 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.605 ' O ' ' HA ' ' A' ' 33' ' ' CYS . 1.4 m -83.04 151.09 25.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.303 -0.873 . . . . 0.0 109.775 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.705 ' O ' ' N ' ' A' ' 7' ' ' LYS . 13.5 t -85.95 121.05 28.03 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.268 -0.895 . . . . 0.0 111.312 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.739 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 3.6 m-30 -105.37 168.82 8.82 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.139 -0.976 . . . . 0.0 109.164 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.802 ' O ' ' HA ' ' A' ' 4' ' ' MET . 84.0 m -144.42 119.32 9.95 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.775 -1.203 . . . . 0.0 110.74 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 1.001 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -86.59 138.72 31.46 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 121.696 0.76 . . . . 0.0 110.433 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.905 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -126.42 166.97 21.77 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 CA-C-O 121.177 0.513 . . . . 0.0 109.834 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.722 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.24 90.1 3.14 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 177.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.729 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.865 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.473 ' HB3' ' OXT' ' A' ' 46' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.421 0.629 . . . . 0.0 110.382 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.901 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -152.46 158.71 42.99 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.389 -0.82 . . . . 0.0 111.121 178.974 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.829 ' O ' HG13 ' A' ' 44' ' ' VAL . 1.6 m -130.38 138.27 50.29 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.76 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 3.9 mtm -108.65 143.43 37.73 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.04 0.924 . . . . 0.0 111.275 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.765 HD12 ' H ' ' A' ' 6' ' ' LYS . 0.5 OUTLIER -122.38 179.87 2.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.765 ' H ' HD12 ' A' ' 5' ' ' ILE . 4.5 mttt -101.91 107.95 19.26 Favored 'General case' 0 C--N 1.295 -1.769 0 O-C-N 121.598 -0.688 . . . . 0.0 110.403 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.719 ' N ' ' O ' ' A' ' 40' ' ' CYS . 6.3 mmtm -94.74 55.4 1.89 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.079 -1.013 . . . . 0.0 109.625 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -64.26 -24.09 67.54 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-O 121.252 0.549 . . . . 0.0 110.174 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -68.24 -5.71 43.32 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.634 -1.386 . . . . 0.0 109.634 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.683 ' CE3' ' HB2' ' A' ' 22' ' ' SER . 40.8 m0 -96.91 -19.9 18.5 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.191 -1.182 . . . . 0.0 110.451 -179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.492 ' O ' ' O ' ' A' ' 12' ' ' LYS . . . 107.78 142.02 10.1 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.422 -1.471 . . . . 0.0 109.422 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -39.02 161.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.592 -0.946 . . . . 0.0 110.311 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 33' ' ' CYS . 37.5 t -100.99 151.74 21.41 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.277 -0.889 . . . . 0.0 110.77 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.824 HD21 HG21 ' A' ' 18' ' ' THR . 0.2 OUTLIER -104.98 -32.13 8.89 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.548 -0.72 . . . . 0.0 110.025 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.817 HG22 ' H ' ' A' ' 16' ' ' ASP . 4.3 mt -116.51 -157.79 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.501 -0.75 . . . . 0.0 110.224 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.817 ' H ' HG22 ' A' ' 15' ' ' ILE . 86.7 m-20 -106.39 -14.97 14.94 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.55 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -113.57 -26.55 8.22 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.681 -0.637 . . . . 0.0 109.782 179.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.824 HG21 HD21 ' A' ' 14' ' ' LEU . 24.8 m -40.16 -58.12 1.54 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.251 -0.906 . . . . 0.0 109.244 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.632 ' SG ' ' O ' ' A' ' 41' ' ' TYR . 13.3 t -53.74 -51.56 62.94 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.362 -0.836 . . . . 0.0 109.026 178.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 17' ' ' THR . . . -47.39 -42.78 22.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.843 -0.536 . . . . 0.0 110.866 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.404 ' NE2' ' HB ' ' A' ' 17' ' ' THR . 50.2 m170 -53.88 -62.4 1.68 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.074 -1.016 . . . . 0.0 109.67 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.683 ' HB2' ' CE3' ' A' ' 10' ' ' TRP . 75.7 p -51.35 -38.95 55.86 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.764 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.573 ' N ' ' HZ3' ' A' ' 10' ' ' TRP . 62.4 m -58.81 -60.94 3.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.421 -0.8 . . . . 0.0 110.443 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.613 ' HA ' ' O ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -50.03 -61.48 2.13 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.344 -0.847 . . . . 0.0 109.56 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.6 m-20 -48.78 -29.94 5.12 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.265 0.555 . . . . 0.0 110.391 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.52 -20.86 49.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.199 -0.938 . . . . 0.0 108.762 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' A' ' 24' ' ' LYS . . . 121.64 40.63 0.52 Allowed Glycine 0 N--CA 1.484 1.877 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.613 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 20.5 m-85 -129.42 170.23 13.94 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.239 -1.153 . . . . 0.0 110.889 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.991 ' HB ' HD12 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -79.11 -28.59 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 43' ' ' LEU . . . 178.0 -158.83 24.07 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.714 ' HA2' ' HA ' ' A' ' 42' ' ' CYS . . . -160.57 -165.07 16.65 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 109.876 -1.289 . . . . 0.0 109.876 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.551 ' C ' ' ND2' ' A' ' 32' ' ' ASN . 0.0 OUTLIER -151.54 177.04 10.73 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.297 -1.119 . . . . 0.0 110.932 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.531 ' N ' ' CG ' ' A' ' 32' ' ' ASN . 57.5 m -137.38 99.55 4.0 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 1.012 ' HB3' HG22 ' A' ' 37' ' ' THR . 0.7 OUTLIER -79.51 121.67 25.5 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.266 -0.896 . . . . 0.0 110.783 -179.0 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.526 ' O ' ' CZ ' ' A' ' 38' ' ' ARG . . . -76.37 -26.72 63.01 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.129 -1.588 . . . . 0.0 109.129 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 24.5 ttm -71.97 -27.95 63.11 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.27 -1.135 . . . . 0.0 109.802 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 1.012 HG22 ' HB3' ' A' ' 34' ' ' LYS . 11.8 t -122.78 1.88 9.41 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.36 -0.837 . . . . 0.0 110.108 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.526 ' CZ ' ' O ' ' A' ' 35' ' ' GLY . 23.0 mmt180 42.04 54.54 4.04 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.251 -0.906 . . . . 0.0 109.876 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.492 ' OG1' HG23 ' A' ' 37' ' ' THR . 1.2 m -129.43 166.42 19.63 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.236 -0.915 . . . . 0.0 110.564 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.719 ' O ' ' N ' ' A' ' 7' ' ' LYS . 2.6 t -107.51 125.39 51.22 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.489 -0.757 . . . . 0.0 110.593 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.75 ' HA ' ' O ' ' A' ' 5' ' ' ILE . 6.2 m-85 -106.34 165.56 11.17 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.024 -1.047 . . . . 0.0 109.342 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.76 ' O ' ' HA ' ' A' ' 4' ' ' MET . 80.0 m -142.17 119.55 11.58 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.644 -1.285 . . . . 0.0 110.91 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.991 HD12 ' HB ' ' A' ' 29' ' ' ILE . 0.2 OUTLIER -83.99 138.36 33.15 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.288 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.901 ' O ' ' HA ' ' A' ' 2' ' ' THR . 1.3 m -125.91 167.72 19.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 CA-C-O 121.238 0.542 . . . . 0.0 109.891 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.719 ' ND2' HD11 ' A' ' 29' ' ' ILE . 0.2 OUTLIER -76.33 90.23 3.19 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 177.899 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.473 ' OXT' ' HB3' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.783 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.786 -176.745 . . . . . . . . 2 2 . 1 stop_ save_