data_1mse_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 1mse _Structure_validation_residue.Date_analyzed 2016-10-06 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 full ' A' A ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.748 1 O4'-C1'-N19 111.55 4.687 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.52 0 O4'-C1'-N19 110.714 3.642 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.44 1 O4'-C1'-N19 111.7 4.875 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.643 0 O4'-C1'-N19 110.458 3.322 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.903 0 O4'-C1'-N19 110.476 3.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.704 0 O4'-C1'-N19 110.471 3.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.125 1 O4'-C1'-N19 111.119 4.149 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.223 0 O4'-C1'-N19 110.954 3.943 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.428 1 O4'-C1'-N19 111.018 4.022 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.634 0 O4'-C1'-N19 110.865 3.831 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.655 0 O4'-C1'-N19 110.229 3.036 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.4 0 O4'-C1'-N19 110.809 3.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.43 1 O4'-C1'-N19 111.423 4.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.532 0 O4'-C1'-N19 110.987 3.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.645 0 O4'-C1'-N19 110.804 3.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.904 0 O4'-C1'-N19 110.596 3.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.517 0 O4'-C1'-N19 110.669 3.586 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.227 0 C5'-C4'-C3' 110.095 -3.07 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.271 1 O4'-C1'-N19 111.045 4.056 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.566 0 O4'-C1'-N19 110.806 3.758 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.359 1 O4'-C1'-N19 111.123 4.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.372 0 O4'-C1'-N19 110.935 3.919 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 89' ' ' MET . . . . . . . . . . . . . 46.9 mtt . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 90' ' ' LEU . . . . . . . . . . . . . 4.1 mm? 58.75 -174.9 0.09 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 91' ' ' ILE . . . . . . . . . . . . . 4.7 tt 32.98 64.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.351 0.632 0 CA-C-O 121.859 0.838 . . . . 0.0 110.599 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 92' ' ' LYS . . . . . . . . . . . . . 38.8 tttp -69.47 -11.24 60.66 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.896 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.28 165.0 32.15 Favored Glycine 0 CA--C 1.532 1.127 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 94' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -58.93 163.53 11.35 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 C-N-CA 122.663 2.242 . . . . 0.0 110.769 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 95' ' ' TRP . . . . . 0.412 ' CE3' ' HB3' ' C' ' 99' ' ' GLU . 1.7 m95 -70.16 104.34 2.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 96' ' ' THR . . . . . . . . . . . . . 6.6 t -64.97 169.26 5.45 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.664 -177.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 97' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -64.37 -27.86 69.3 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 176.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 98' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -90.12 36.21 0.87 Allowed 'General case' 0 C--N 1.345 0.38 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.372 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 99' ' ' GLU . . . . . 0.412 ' HB3' ' CE3' ' C' ' 95' ' ' TRP . 47.9 mt-10 -147.61 -53.96 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 176.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 100' ' ' ASP . . . . . 0.454 ' HB3' HE22 ' C' ' 101' ' ' GLN . 3.3 t0 -57.86 -48.6 79.32 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.225 178.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 101' ' ' GLN . . . . . 0.499 ' NE2' ' N ' ' C' ' 101' ' ' GLN . 0.0 OUTLIER -93.68 21.87 6.01 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.583 0.629 . . . . 0.0 109.675 -176.553 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 102' ' ' ARG . . . . . . . . . . . . . 34.7 mmt-85 -120.48 -49.61 2.25 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 p -61.42 -25.73 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 104' ' ' ILE . . . . . . . . . . . . . 14.6 tt -54.0 -38.91 38.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.427 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 105' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -84.43 -30.35 25.39 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 83.9 mt -67.21 -30.99 71.07 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 119.178 -0.439 . . . . 0.0 111.494 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 107' ' ' VAL . . . . . . . . . . . . . 73.0 t -75.48 -37.43 37.54 Favored 'Isoleucine or valine' 0 C--N 1.346 0.452 0 CA-C-N 119.055 0.843 . . . . 0.0 109.046 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -66.02 -20.26 66.13 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 109' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -90.59 -52.67 4.78 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.602 0.361 . . . . 0.0 110.497 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 110' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -93.89 -59.06 2.07 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.139 0.175 . . . . 0.0 111.032 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 111' ' ' GLY . . . . . . . . . . . . . . . 128.06 160.16 10.3 Favored Glycine 0 CA--C 1.535 1.29 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 112' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -75.87 60.1 5.96 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.068 2.512 . . . . 0.0 110.839 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 113' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -174.37 42.06 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 114' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -153.22 30.07 0.49 Allowed 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -177.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 115' ' ' TRP . . . . . . . . . . . . . 50.6 m95 -55.35 -20.81 12.82 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.173 -178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 6.0 p -67.79 -38.44 83.35 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 117' ' ' VAL . . . . . . . . . . . . . 95.4 t -80.79 -40.77 19.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 118' ' ' ILE . . . . . . . . . . . . . 19.2 mm -54.28 -52.68 36.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 119' ' ' ALA . . . . . . . . . . . . . . . -60.24 -27.48 67.25 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.828 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 120' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.76 -29.64 70.26 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 110.535 -0.172 . . . . 0.0 110.535 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 121' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 -91.42 -43.5 9.69 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 -178.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 84.8 mt -74.46 -11.94 60.36 Favored 'General case' 0 C--N 1.342 0.253 0 O-C-N 122.98 0.175 . . . . 0.0 110.696 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 123' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm 65.25 -72.42 0.07 Allowed 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.349 1.06 . . . . 0.0 113.038 177.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 124' ' ' GLY . . . . . . . . . . . . . . . -78.65 -41.93 14.68 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -174.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 125' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -65.38 99.39 0.4 Allowed 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -178.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 126' ' ' ILE . . . . . . . . . . . . . 42.3 pt -65.84 161.11 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 127' ' ' GLY . . . . . . . . . . . . . . . -51.24 -37.43 38.46 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 111.389 -0.684 . . . . 0.0 111.389 -177.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 128' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -56.23 -59.67 4.61 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 129' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -55.39 -44.22 75.92 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 122.499 0.32 . . . . 0.0 110.613 -178.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 130' ' ' CYS . . . . . . . . . . . . . 82.5 m -54.47 -49.66 69.57 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.35 -42.98 92.26 Favored 'General case' 0 C--O 1.222 -0.342 0 CA-C-O 119.617 -0.23 . . . . 0.0 110.67 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 132' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -57.08 -50.78 71.72 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 118.083 0.401 . . . . 0.0 110.15 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -51.96 67.7 Favored 'General case' 0 C--N 1.342 0.26 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 134' ' ' TRP . . . . . . . . . . . . . 36.9 t-105 -56.19 -70.88 0.1 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.663 -177.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 135' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -68.69 91.65 0.44 Allowed 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 136' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -175.85 -66.53 0.01 OUTLIER 'General case' 0 C--N 1.338 0.107 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 137' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -173.7 21.68 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.151 177.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 138' ' ' LEU . . . . . . . . . . . . . 1.8 tt -82.52 -48.42 11.04 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 139' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -34.99 116.56 0.54 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 114.371 -1.286 . . . . 0.0 112.168 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 140' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -68.07 -29.35 33.69 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 N-CA-C 106.8 -2.038 . . . . 0.0 106.8 173.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 141' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -55.58 -38.95 70.06 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 114.693 -1.14 . . . . 0.0 108.165 176.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 142' ' ' VAL . . . . . . . . . . . . . 59.7 t -100.26 80.0 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.412 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 177.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 143' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -45.36 125.87 5.96 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.251 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 144' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -52.32 118.77 3.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.287 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 145' ' ' THR . . . . . . . . . . . . . 13.1 t -156.01 136.85 13.49 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 146' ' ' SER . . . . . . . . . . . . . 13.1 m -84.46 159.0 20.85 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.844 0.354 . . . . 0.0 110.615 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 147' ' ' TRP . . . . . 0.421 ' CH2' HG13 ' C' ' 181' ' ' ILE . 74.2 m95 -69.98 154.04 42.45 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.42 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 148' ' ' THR . . . . . . . . . . . . . 6.8 t -150.23 -170.36 3.63 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 149' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -53.44 -43.95 68.46 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.002 0.364 . . . . 0.0 110.652 -178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 150' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -73.41 -5.24 38.58 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 151' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -116.51 -27.93 6.59 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 118.533 0.606 . . . . 0.0 109.958 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 152' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -62.5 -31.93 72.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -65.4 -23.05 66.86 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.286 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 154' ' ' ILE . . . . . . . . . . . . . 23.9 mm -72.27 -54.94 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 155' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.04 -39.48 79.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.487 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 156' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -52.87 -39.25 62.48 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 117.65 0.204 . . . . 0.0 110.945 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 157' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -89.19 -49.82 6.51 Favored 'General case' 0 C--N 1.339 0.118 0 C-N-CA 122.197 0.199 . . . . 0.0 110.891 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 158' ' ' ALA . . . . . . . . . . . . . . . -55.86 -43.87 77.54 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 159' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -66.98 -18.97 65.63 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 122.384 0.273 . . . . 0.0 110.438 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 160' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.1 -18.88 52.53 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 122.314 -0.242 . . . . 0.0 110.927 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 161' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.23 -42.1 3.58 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-O 120.597 0.237 . . . . 0.0 110.406 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 162' ' ' LEU . . . . . . . . . . . . . 32.7 mt -92.99 -51.11 5.22 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.166 0.586 . . . . 0.0 109.897 -177.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 163' ' ' GLY . . . . . . . . . . . . . . . 85.01 -96.23 2.04 Favored Glycine 0 N--CA 1.438 -1.221 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 178.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 45.1 p-10 -111.35 26.08 11.04 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.098 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 165' ' ' ARG . . . . . . . . . . . . . 32.3 mtt-85 -99.92 59.56 1.06 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 176.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 166' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -55.75 -19.42 11.09 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.518 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.83 -41.59 91.69 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 168' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -82.25 -43.86 17.05 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 169' ' ' ILE . . . . . . . . . . . . . 46.4 mt -52.67 -48.74 48.08 Favored 'Isoleucine or valine' 0 C--N 1.343 0.321 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 170' ' ' ALA . . . . . . . . . . . . . . . -53.22 -53.93 43.43 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.902 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 171' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -62.09 -32.55 73.11 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 -178.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 172' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.98 -18.91 60.81 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.309 0.244 . . . . 0.0 110.426 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 173' ' ' LEU . . . . . . . . . . . . . 1.9 tt -116.75 90.36 31.5 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 174' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -63.36 103.36 0.37 Allowed 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 122.355 2.037 . . . . 0.0 110.514 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 175' ' ' GLY . . . . . . . . . . . . . . . 139.41 -79.36 0.29 Allowed Glycine 0 C--N 1.34 0.753 0 N-CA-C 108.996 -1.641 . . . . 0.0 108.996 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.84 95.86 1.19 Allowed 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 177' ' ' THR . . . . . . . . . . . . . 25.4 m -99.06 137.3 37.79 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.184 -177.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 178' ' ' ASP . . . . . . . . . . . . . 26.1 t0 40.52 -103.0 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.502 1.121 . . . . 0.0 112.451 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 179' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -49.5 -34.49 17.25 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 123.04 0.536 . . . . 0.0 111.986 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 180' ' ' ALA . . . . . . . . . . . . . . . -51.06 -60.16 3.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 118.545 0.612 . . . . 0.0 111.168 -177.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 181' ' ' ILE . . . . . 0.421 HG13 ' CH2' ' C' ' 147' ' ' TRP . 10.6 tt -82.59 -32.96 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 122.04 0.136 . . . . 0.0 111.11 -177.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 182' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -64.77 -56.36 14.03 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 183' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -56.1 -37.33 69.25 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 184' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -64.51 -52.85 55.73 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.44 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 185' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -53.37 -64.67 0.75 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.781 0.324 . . . . 0.0 111.491 -176.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 186' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -78.64 44.64 0.54 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.028 -175.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 187' ' ' SER . . . . . . . . . . . . . 69.2 m -155.97 -46.69 0.08 Allowed 'General case' 0 CA--C 1.524 -0.043 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 188' ' ' THR . . . . . . . . . . . . . 19.1 p -99.69 -38.52 8.67 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.151 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 189' ' ' MET . . . . . . . . . . . . . 39.4 mmm -112.21 18.7 18.4 Favored 'General case' 0 C--N 1.344 0.352 0 C-N-CA 122.709 0.403 . . . . 0.0 111.505 -176.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 190' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -63.56 -24.6 67.88 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 191' ' ' ARG . . . . . . . . . . . . . 20.6 ptt85 -72.73 -0.86 14.34 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 122.962 0.505 . . . . 0.0 110.582 178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 192' ' ' LYS . . . . . . . . . . . . . 91.2 mttt 64.05 74.33 0.41 Allowed 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.279 0.632 . . . . 0.0 109.787 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 193' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.255 1.352 0 CA-C-O 115.853 -2.023 . . . . 0.0 109.78 -179.894 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.748 1 O4'-C1'-N19 111.55 4.687 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.52 0 O4'-C1'-N19 110.714 3.642 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.44 1 O4'-C1'-N19 111.7 4.875 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.643 0 O4'-C1'-N19 110.458 3.322 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.903 0 O4'-C1'-N19 110.476 3.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.704 0 O4'-C1'-N19 110.471 3.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.125 1 O4'-C1'-N19 111.119 4.149 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.223 0 O4'-C1'-N19 110.954 3.943 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.428 1 O4'-C1'-N19 111.018 4.022 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.634 0 O4'-C1'-N19 110.865 3.831 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.655 0 O4'-C1'-N19 110.229 3.036 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.4 0 O4'-C1'-N19 110.809 3.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.43 1 O4'-C1'-N19 111.423 4.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.532 0 O4'-C1'-N19 110.987 3.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.645 0 O4'-C1'-N19 110.804 3.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.904 0 O4'-C1'-N19 110.596 3.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 27' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.517 0 O4'-C1'-N19 110.669 3.586 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.227 0 C5'-C4'-C3' 110.095 -3.07 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.271 1 O4'-C1'-N19 111.045 4.056 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.566 0 O4'-C1'-N19 110.806 3.758 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.359 1 O4'-C1'-N19 111.123 4.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.372 0 O4'-C1'-N19 110.935 3.919 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 89' ' ' MET . . . . . . . . . . . . . 46.9 mtt . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 90' ' ' LEU . . . . . . . . . . . . . 4.1 mm? 58.75 -174.9 0.09 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 91' ' ' ILE . . . . . . . . . . . . . 4.7 tt 32.98 64.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.351 0.632 0 CA-C-O 121.859 0.838 . . . . 0.0 110.599 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 92' ' ' LYS . . . . . . . . . . . . . 38.8 tttp -69.47 -11.24 60.66 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.896 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.28 165.0 32.15 Favored Glycine 0 CA--C 1.532 1.127 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 94' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -58.93 163.53 11.35 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 C-N-CA 122.663 2.242 . . . . 0.0 110.769 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 95' ' ' TRP . . . . . 0.433 ' CE3' ' HB3' ' C' ' 99' ' ' GLU . 1.7 m95 -70.16 104.34 2.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 96' ' ' THR . . . . . . . . . . . . . 6.6 t -64.97 169.26 5.45 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.664 -177.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 97' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -64.37 -27.86 69.3 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 176.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 98' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -90.12 36.21 0.87 Allowed 'General case' 0 C--N 1.345 0.38 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.372 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 99' ' ' GLU . . . . . 0.433 ' HB3' ' CE3' ' C' ' 95' ' ' TRP . 47.9 mt-10 -147.61 -53.96 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 176.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 100' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -57.86 -48.6 79.32 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.225 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 101' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -93.68 21.87 6.01 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.583 0.629 . . . . 0.0 109.675 -176.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 102' ' ' ARG . . . . . . . . . . . . . 34.7 mmt-85 -120.48 -49.61 2.25 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 p -61.42 -25.73 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 104' ' ' ILE . . . . . . . . . . . . . 14.6 tt -54.0 -38.91 38.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.427 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 105' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -84.43 -30.35 25.39 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 83.9 mt -67.21 -30.99 71.07 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 119.178 -0.439 . . . . 0.0 111.494 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 107' ' ' VAL . . . . . . . . . . . . . 73.0 t -75.48 -37.43 37.54 Favored 'Isoleucine or valine' 0 C--N 1.346 0.452 0 CA-C-N 119.055 0.843 . . . . 0.0 109.046 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -66.02 -20.26 66.13 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 109' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -90.59 -52.67 4.78 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.602 0.361 . . . . 0.0 110.497 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 110' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -93.89 -59.06 2.07 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.139 0.175 . . . . 0.0 111.032 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 111' ' ' GLY . . . . . . . . . . . . . . . 128.06 160.16 10.3 Favored Glycine 0 CA--C 1.535 1.29 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 112' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -75.87 60.1 5.96 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.068 2.512 . . . . 0.0 110.839 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 113' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -174.37 42.06 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 114' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -153.22 30.07 0.49 Allowed 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -177.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 115' ' ' TRP . . . . . . . . . . . . . 50.6 m95 -55.35 -20.81 12.82 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.173 -178.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 6.0 p -67.79 -38.44 83.35 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 117' ' ' VAL . . . . . . . . . . . . . 95.4 t -80.79 -40.77 19.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 118' ' ' ILE . . . . . . . . . . . . . 19.2 mm -54.28 -52.68 36.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 119' ' ' ALA . . . . . . . . . . . . . . . -60.24 -27.48 67.25 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.828 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 120' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.76 -29.64 70.26 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 110.535 -0.172 . . . . 0.0 110.535 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 121' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 -91.42 -43.5 9.69 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 -178.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 84.8 mt -74.46 -11.94 60.36 Favored 'General case' 0 C--N 1.342 0.253 0 O-C-N 122.98 0.175 . . . . 0.0 110.696 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 123' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm 65.25 -72.42 0.07 Allowed 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.349 1.06 . . . . 0.0 113.038 177.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 124' ' ' GLY . . . . . . . . . . . . . . . -78.65 -41.93 14.68 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -174.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 125' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -65.38 99.39 0.4 Allowed 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -178.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 126' ' ' ILE . . . . . . . . . . . . . 42.3 pt -65.84 161.11 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 127' ' ' GLY . . . . . . . . . . . . . . . -51.24 -37.43 38.46 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 111.389 -0.684 . . . . 0.0 111.389 -177.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 128' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -56.23 -59.67 4.61 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 129' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -55.39 -44.22 75.92 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 122.499 0.32 . . . . 0.0 110.613 -178.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 130' ' ' CYS . . . . . . . . . . . . . 82.5 m -54.47 -49.66 69.57 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.35 -42.98 92.26 Favored 'General case' 0 C--O 1.222 -0.342 0 CA-C-O 119.617 -0.23 . . . . 0.0 110.67 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 132' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -57.08 -50.78 71.72 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 118.083 0.401 . . . . 0.0 110.15 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 133' ' ' ARG . . . . . 0.792 ' HD2' HD12 ' C' ' 138' ' ' LEU . 0.0 OUTLIER -59.28 -51.96 67.7 Favored 'General case' 0 C--N 1.342 0.26 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.782 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 134' ' ' TRP . . . . . . . . . . . . . 36.9 t-105 -56.19 -70.88 0.1 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.663 -177.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 135' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -68.69 91.65 0.44 Allowed 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 136' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -175.85 -66.53 0.01 OUTLIER 'General case' 0 C--N 1.338 0.107 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 137' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -173.7 21.68 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.151 177.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 138' ' ' LEU . . . . . 0.792 HD12 ' HD2' ' C' ' 133' ' ' ARG . 1.8 tt -82.52 -48.42 11.04 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 139' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -34.99 116.56 0.54 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 114.371 -1.286 . . . . 0.0 112.168 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 140' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -68.07 -29.35 33.69 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 N-CA-C 106.8 -2.038 . . . . 0.0 106.8 173.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 141' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -55.58 -38.95 70.06 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 114.693 -1.14 . . . . 0.0 108.165 176.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 142' ' ' VAL . . . . . . . . . . . . . 59.7 t -100.26 80.0 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.412 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 177.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 143' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -45.36 125.87 5.96 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.251 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 144' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -52.32 118.77 3.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.287 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 145' ' ' THR . . . . . . . . . . . . . 13.1 t -156.01 136.85 13.49 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 146' ' ' SER . . . . . . . . . . . . . 13.1 m -84.46 159.0 20.85 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.844 0.354 . . . . 0.0 110.615 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 147' ' ' TRP . . . . . 0.404 ' CH2' HG13 ' C' ' 181' ' ' ILE . 74.2 m95 -69.98 154.04 42.45 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.42 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 148' ' ' THR . . . . . . . . . . . . . 6.8 t -150.23 -170.36 3.63 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 149' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -53.44 -43.95 68.46 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.002 0.364 . . . . 0.0 110.652 -178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 150' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -73.41 -5.24 38.58 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 151' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -116.51 -27.93 6.59 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 118.533 0.606 . . . . 0.0 109.958 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 152' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -62.5 -31.93 72.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -65.4 -23.05 66.86 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.286 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 154' ' ' ILE . . . . . 0.52 HG21 HD12 ' C' ' 173' ' ' LEU . 23.9 mm -72.27 -54.94 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 155' ' ' ILE . . . . . 0.437 HG13 HD11 ' C' ' 181' ' ' ILE . 0.4 OUTLIER -69.04 -39.48 79.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.487 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.222 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 156' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -52.87 -39.25 62.48 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 117.65 0.204 . . . . 0.0 110.945 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 157' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -89.19 -49.82 6.51 Favored 'General case' 0 C--N 1.339 0.118 0 C-N-CA 122.197 0.199 . . . . 0.0 110.891 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 158' ' ' ALA . . . . . . . . . . . . . . . -55.86 -43.87 77.54 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 159' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -66.98 -18.97 65.63 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 122.384 0.273 . . . . 0.0 110.438 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 160' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.1 -18.88 52.53 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 122.314 -0.242 . . . . 0.0 110.927 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 161' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.23 -42.1 3.58 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-O 120.597 0.237 . . . . 0.0 110.406 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 162' ' ' LEU . . . . . . . . . . . . . 32.7 mt -92.99 -51.11 5.22 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.166 0.586 . . . . 0.0 109.897 -177.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 163' ' ' GLY . . . . . . . . . . . . . . . 85.01 -96.23 2.04 Favored Glycine 0 N--CA 1.438 -1.221 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 178.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 45.1 p-10 -111.35 26.08 11.04 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.098 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 165' ' ' ARG . . . . . . . . . . . . . 32.3 mtt-85 -99.92 59.56 1.06 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 176.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 166' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -55.75 -19.42 11.09 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.518 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.83 -41.59 91.69 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 168' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -82.25 -43.86 17.05 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 169' ' ' ILE . . . . . 0.488 ' CG2' HD13 ' C' ' 181' ' ' ILE . 46.4 mt -52.67 -48.74 48.08 Favored 'Isoleucine or valine' 0 C--N 1.343 0.321 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 170' ' ' ALA . . . . . . . . . . . . . . . -53.22 -53.93 43.43 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.902 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 171' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -62.09 -32.55 73.11 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 -178.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 172' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.98 -18.91 60.81 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.309 0.244 . . . . 0.0 110.426 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 173' ' ' LEU . . . . . 0.52 HD12 HG21 ' C' ' 154' ' ' ILE . 1.9 tt -116.75 90.36 31.5 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 -179.264 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 174' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -63.36 103.36 0.37 Allowed 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 122.355 2.037 . . . . 0.0 110.514 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 175' ' ' GLY . . . . . . . . . . . . . . . 139.41 -79.36 0.29 Allowed Glycine 0 C--N 1.34 0.753 0 N-CA-C 108.996 -1.641 . . . . 0.0 108.996 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.84 95.86 1.19 Allowed 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 177' ' ' THR . . . . . . . . . . . . . 25.4 m -99.06 137.3 37.79 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.184 -177.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 178' ' ' ASP . . . . . . . . . . . . . 26.1 t0 40.52 -103.0 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.502 1.121 . . . . 0.0 112.451 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 179' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -49.5 -34.49 17.25 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 123.04 0.536 . . . . 0.0 111.986 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 180' ' ' ALA . . . . . . . . . . . . . . . -51.06 -60.16 3.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 118.545 0.612 . . . . 0.0 111.168 -177.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 181' ' ' ILE . . . . . 0.488 HD13 ' CG2' ' C' ' 169' ' ' ILE . 10.6 tt -82.59 -32.96 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 122.04 0.136 . . . . 0.0 111.11 -177.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 182' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -64.77 -56.36 14.03 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 183' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -56.1 -37.33 69.25 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 184' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -64.51 -52.85 55.73 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.44 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 185' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -53.37 -64.67 0.75 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.781 0.324 . . . . 0.0 111.491 -176.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 186' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -78.64 44.64 0.54 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.028 -175.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 187' ' ' SER . . . . . . . . . . . . . 69.2 m -155.97 -46.69 0.08 Allowed 'General case' 0 CA--C 1.524 -0.043 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 188' ' ' THR . . . . . . . . . . . . . 19.1 p -99.69 -38.52 8.67 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.151 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 189' ' ' MET . . . . . . . . . . . . . 39.4 mmm -112.21 18.7 18.4 Favored 'General case' 0 C--N 1.344 0.352 0 C-N-CA 122.709 0.403 . . . . 0.0 111.505 -176.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 190' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -63.56 -24.6 67.88 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 191' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' C' ' 191' ' ' ARG . 20.6 ptt85 -72.73 -0.86 14.34 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 122.962 0.505 . . . . 0.0 110.582 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 192' ' ' LYS . . . . . . . . . . . . . 91.2 mttt 64.05 74.33 0.41 Allowed 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.279 0.632 . . . . 0.0 109.787 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 193' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.255 1.352 0 CA-C-O 115.853 -2.023 . . . . 0.0 109.78 -179.894 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.748 1 O4'-C1'-N19 111.55 4.687 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.52 0 O4'-C1'-N19 110.714 3.642 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.44 1 O4'-C1'-N19 111.7 4.875 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.643 0 O4'-C1'-N19 110.458 3.322 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.903 0 O4'-C1'-N19 110.476 3.346 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.704 0 O4'-C1'-N19 110.471 3.339 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.125 1 O4'-C1'-N19 111.119 4.149 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.223 0 O4'-C1'-N19 110.954 3.943 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.428 1 O4'-C1'-N19 111.018 4.022 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.634 0 O4'-C1'-N19 110.865 3.831 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.655 0 O4'-C1'-N19 110.229 3.036 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.4 0 O4'-C1'-N19 110.809 3.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.43 1 O4'-C1'-N19 111.423 4.529 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.532 0 O4'-C1'-N19 110.987 3.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.645 0 O4'-C1'-N19 110.804 3.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.904 0 O4'-C1'-N19 110.596 3.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.517 0 O4'-C1'-N19 110.669 3.586 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.227 0 C5'-C4'-C3' 110.095 -3.07 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.271 1 O4'-C1'-N19 111.045 4.056 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.566 0 O4'-C1'-N19 110.806 3.758 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.359 1 O4'-C1'-N19 111.123 4.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.372 0 O4'-C1'-N19 110.935 3.919 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 89' ' ' MET . . . . . . . . . . . . . 46.9 mtt . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 90' ' ' LEU . . . . . . . . . . . . . 4.1 mm? 58.75 -174.9 0.09 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 91' ' ' ILE . . . . . . . . . . . . . 4.7 tt 32.98 64.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.351 0.632 0 CA-C-O 121.859 0.838 . . . . 0.0 110.599 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 92' ' ' LYS . . . . . . . . . . . . . 38.8 tttp -69.47 -11.24 60.66 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.896 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.28 165.0 32.15 Favored Glycine 0 CA--C 1.532 1.127 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 94' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -58.93 163.53 11.35 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 C-N-CA 122.663 2.242 . . . . 0.0 110.769 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 95' ' ' TRP . . . . . 0.433 ' CE3' ' HB3' ' C' ' 99' ' ' GLU . 1.7 m95 -70.16 104.34 2.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 96' ' ' THR . . . . . . . . . . . . . 6.6 t -64.97 169.26 5.45 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.664 -177.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 97' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -64.37 -27.86 69.3 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 176.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 98' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -90.12 36.21 0.87 Allowed 'General case' 0 C--N 1.345 0.38 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.372 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 99' ' ' GLU . . . . . 0.433 ' HB3' ' CE3' ' C' ' 95' ' ' TRP . 47.9 mt-10 -147.61 -53.96 0.21 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 176.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 100' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -57.86 -48.6 79.32 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.225 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 101' ' ' GLN . . . . . 0.542 HE21 ' H ' ' C' ' 101' ' ' GLN . 0.0 OUTLIER -93.68 21.87 6.01 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.583 0.629 . . . . 0.0 109.675 -176.553 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 102' ' ' ARG . . . . . . . . . . . . . 34.7 mmt-85 -120.48 -49.61 2.25 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 p -61.42 -25.73 37.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 104' ' ' ILE . . . . . . . . . . . . . 14.6 tt -54.0 -38.91 38.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.427 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 105' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -84.43 -30.35 25.39 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 83.9 mt -67.21 -30.99 71.07 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 119.178 -0.439 . . . . 0.0 111.494 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 107' ' ' VAL . . . . . . . . . . . . . 73.0 t -75.48 -37.43 37.54 Favored 'Isoleucine or valine' 0 C--N 1.346 0.452 0 CA-C-N 119.055 0.843 . . . . 0.0 109.046 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 60.5 mt-30 -66.02 -20.26 66.13 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 109' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -90.59 -52.67 4.78 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.602 0.361 . . . . 0.0 110.497 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 110' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -93.89 -59.06 2.07 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.139 0.175 . . . . 0.0 111.032 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 111' ' ' GLY . . . . . . . . . . . . . . . 128.06 160.16 10.3 Favored Glycine 0 CA--C 1.535 1.29 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 112' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -75.87 60.1 5.96 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.068 2.512 . . . . 0.0 110.839 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 113' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -174.37 42.06 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 114' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -153.22 30.07 0.49 Allowed 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -177.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 115' ' ' TRP . . . . . . . . . . . . . 50.6 m95 -55.35 -20.81 12.82 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.173 -178.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 116' ' ' SER . . . . . . . . . . . . . 6.0 p -67.79 -38.44 83.35 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 117' ' ' VAL . . . . . . . . . . . . . 95.4 t -80.79 -40.77 19.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 118' ' ' ILE . . . . . . . . . . . . . 19.2 mm -54.28 -52.68 36.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 119' ' ' ALA . . . . . . . . . . . . . . . -60.24 -27.48 67.25 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.828 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 120' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -61.76 -29.64 70.26 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 110.535 -0.172 . . . . 0.0 110.535 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 121' ' ' HIS . . . . . . . . . . . . . 41.2 m-70 -91.42 -43.5 9.69 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 -178.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 84.8 mt -74.46 -11.94 60.36 Favored 'General case' 0 C--N 1.342 0.253 0 O-C-N 122.98 0.175 . . . . 0.0 110.696 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 123' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm 65.25 -72.42 0.07 Allowed 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.349 1.06 . . . . 0.0 113.038 177.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 124' ' ' GLY . . . . . . . . . . . . . . . -78.65 -41.93 14.68 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 -174.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 125' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -65.38 99.39 0.4 Allowed 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 -178.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 126' ' ' ILE . . . . . . . . . . . . . 42.3 pt -65.84 161.11 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 127' ' ' GLY . . . . . . . . . . . . . . . -51.24 -37.43 38.46 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 111.389 -0.684 . . . . 0.0 111.389 -177.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 128' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -56.23 -59.67 4.61 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 129' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -55.39 -44.22 75.92 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 122.499 0.32 . . . . 0.0 110.613 -178.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 130' ' ' CYS . . . . . . . . . . . . . 82.5 m -54.47 -49.66 69.57 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.35 -42.98 92.26 Favored 'General case' 0 C--O 1.222 -0.342 0 CA-C-O 119.617 -0.23 . . . . 0.0 110.67 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 132' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -57.08 -50.78 71.72 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 118.083 0.401 . . . . 0.0 110.15 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 133' ' ' ARG . . . . . 0.792 ' HD2' HD12 ' C' ' 138' ' ' LEU . 0.0 OUTLIER -59.28 -51.96 67.7 Favored 'General case' 0 C--N 1.342 0.26 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.782 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 134' ' ' TRP . . . . . . . . . . . . . 36.9 t-105 -56.19 -70.88 0.1 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.663 -177.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 135' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -68.69 91.65 0.44 Allowed 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 136' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -175.85 -66.53 0.01 OUTLIER 'General case' 0 C--N 1.338 0.107 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 137' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -173.7 21.68 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.151 177.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 138' ' ' LEU . . . . . 0.792 HD12 ' HD2' ' C' ' 133' ' ' ARG . 1.8 tt -82.52 -48.42 11.04 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 139' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -34.99 116.56 0.54 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 114.371 -1.286 . . . . 0.0 112.168 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 140' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -68.07 -29.35 33.69 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 N-CA-C 106.8 -2.038 . . . . 0.0 106.8 173.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 141' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -55.58 -38.95 70.06 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 114.693 -1.14 . . . . 0.0 108.165 176.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 142' ' ' VAL . . . . . . . . . . . . . 59.7 t -100.26 80.0 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.412 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 177.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 143' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -45.36 125.87 5.96 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.251 -178.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 144' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -52.32 118.77 3.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.287 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 145' ' ' THR . . . . . . . . . . . . . 13.1 t -156.01 136.85 13.49 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 146' ' ' SER . . . . . . . . . . . . . 13.1 m -84.46 159.0 20.85 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.844 0.354 . . . . 0.0 110.615 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 147' ' ' TRP . . . . . 0.404 ' CH2' HG13 ' C' ' 181' ' ' ILE . 74.2 m95 -69.98 154.04 42.45 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.42 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 148' ' ' THR . . . . . . . . . . . . . 6.8 t -150.23 -170.36 3.63 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 149' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -53.44 -43.95 68.46 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.002 0.364 . . . . 0.0 110.652 -178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 150' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -73.41 -5.24 38.58 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 151' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -116.51 -27.93 6.59 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 118.533 0.606 . . . . 0.0 109.958 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 152' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -62.5 -31.93 72.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 178.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 153' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -65.4 -23.05 66.86 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.286 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 154' ' ' ILE . . . . . 0.52 HG21 HD12 ' C' ' 173' ' ' LEU . 23.9 mm -72.27 -54.94 14.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 155' ' ' ILE . . . . . 0.437 HG13 HD11 ' C' ' 181' ' ' ILE . 0.4 OUTLIER -69.04 -39.48 79.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.487 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.222 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 156' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -52.87 -39.25 62.48 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 117.65 0.204 . . . . 0.0 110.945 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 157' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -89.19 -49.82 6.51 Favored 'General case' 0 C--N 1.339 0.118 0 C-N-CA 122.197 0.199 . . . . 0.0 110.891 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 158' ' ' ALA . . . . . . . . . . . . . . . -55.86 -43.87 77.54 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 159' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -66.98 -18.97 65.63 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 122.384 0.273 . . . . 0.0 110.438 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 160' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.1 -18.88 52.53 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 122.314 -0.242 . . . . 0.0 110.927 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 161' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.23 -42.1 3.58 Favored 'General case' 0 C--N 1.347 0.462 0 CA-C-O 120.597 0.237 . . . . 0.0 110.406 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 162' ' ' LEU . . . . . . . . . . . . . 32.7 mt -92.99 -51.11 5.22 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.166 0.586 . . . . 0.0 109.897 -177.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 163' ' ' GLY . . . . . . . . . . . . . . . 85.01 -96.23 2.04 Favored Glycine 0 N--CA 1.438 -1.221 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 178.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 164' ' ' ASN . . . . . . . . . . . . . 45.1 p-10 -111.35 26.08 11.04 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.098 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 165' ' ' ARG . . . . . . . . . . . . . 32.3 mtt-85 -99.92 59.56 1.06 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 176.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 166' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -55.75 -19.42 11.09 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.518 -178.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 167' ' ' ALA . . . . . . . . . . . . . . . -59.83 -41.59 91.69 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 168' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -82.25 -43.86 17.05 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 169' ' ' ILE . . . . . 0.488 ' CG2' HD13 ' C' ' 181' ' ' ILE . 46.4 mt -52.67 -48.74 48.08 Favored 'Isoleucine or valine' 0 C--N 1.343 0.321 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 170' ' ' ALA . . . . . . . . . . . . . . . -53.22 -53.93 43.43 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.902 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 171' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -62.09 -32.55 73.11 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 -178.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 172' ' ' LEU . . . . . . . . . . . . . 2.9 tt -73.98 -18.91 60.81 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 122.309 0.244 . . . . 0.0 110.426 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 173' ' ' LEU . . . . . 0.52 HD12 HG21 ' C' ' 154' ' ' ILE . 1.9 tt -116.75 90.36 31.5 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 -179.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 174' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -63.36 103.36 0.37 Allowed 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 122.355 2.037 . . . . 0.0 110.514 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 175' ' ' GLY . . . . . . . . . . . . . . . 139.41 -79.36 0.29 Allowed Glycine 0 C--N 1.34 0.753 0 N-CA-C 108.996 -1.641 . . . . 0.0 108.996 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 176' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.84 95.86 1.19 Allowed 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 177' ' ' THR . . . . . . . . . . . . . 25.4 m -99.06 137.3 37.79 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.184 -177.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 178' ' ' ASP . . . . . . . . . . . . . 26.1 t0 40.52 -103.0 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.502 1.121 . . . . 0.0 112.451 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 179' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -49.5 -34.49 17.25 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 123.04 0.536 . . . . 0.0 111.986 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 180' ' ' ALA . . . . . . . . . . . . . . . -51.06 -60.16 3.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 118.545 0.612 . . . . 0.0 111.168 -177.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 181' ' ' ILE . . . . . 0.488 HD13 ' CG2' ' C' ' 169' ' ' ILE . 10.6 tt -82.59 -32.96 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 122.04 0.136 . . . . 0.0 111.11 -177.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 182' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -64.77 -56.36 14.03 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 183' ' ' ASN . . . . . 0.453 ' HA ' HD21 ' C' ' 186' ' ' ASN . 48.7 t30 -56.1 -37.33 69.25 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -178.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 184' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -64.51 -52.85 55.73 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.44 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 185' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -53.37 -64.67 0.75 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.781 0.324 . . . . 0.0 111.491 -176.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 186' ' ' ASN . . . . . 0.453 HD21 ' HA ' ' C' ' 183' ' ' ASN . 0.3 OUTLIER -78.64 44.64 0.54 Allowed 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.028 -175.46 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 187' ' ' SER . . . . . . . . . . . . . 69.2 m -155.97 -46.69 0.08 Allowed 'General case' 0 CA--C 1.524 -0.043 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 188' ' ' THR . . . . . . . . . . . . . 19.1 p -99.69 -38.52 8.67 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.151 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 189' ' ' MET . . . . . . . . . . . . . 39.4 mmm -112.21 18.7 18.4 Favored 'General case' 0 C--N 1.344 0.352 0 C-N-CA 122.709 0.403 . . . . 0.0 111.505 -176.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 190' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -63.56 -24.6 67.88 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 191' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' C' ' 191' ' ' ARG . 20.6 ptt85 -72.73 -0.86 14.34 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 122.962 0.505 . . . . 0.0 110.582 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 192' ' ' LYS . . . . . . . . . . . . . 91.2 mttt 64.05 74.33 0.41 Allowed 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.279 0.632 . . . . 0.0 109.787 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 193' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.255 1.352 0 CA-C-O 115.853 -2.023 . . . . 0.0 109.78 -179.894 . . . . . . . . 0 0 . 1 stop_ save_