data_1mbe_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 1mbe _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 ' 38' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -177.83 63.25 0.09 OUTLIER Glycine 0 CA--C 1.524 0.637 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -55.95 112.96 1.32 Allowed 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 37.8 p 45.61 40.25 5.8 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.265 0.626 . . . . 0.0 110.59 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.6 ttt85 -56.78 135.37 55.47 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 31.4 m95 -96.29 156.43 16.34 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 74.3 p -130.36 154.57 47.54 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.9 ttt-85 -57.01 -38.71 73.49 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 -178.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.13 -36.63 75.56 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -77.28 -40.3 45.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -57.52 -36.75 71.98 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -61.9 -41.62 98.11 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 178.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -64.46 -48.75 74.08 Favored 'General case' 0 C--N 1.341 0.2 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 65.1 tp -58.0 -46.75 84.72 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.6 ttmt -56.27 -52.96 62.56 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 57.5 tttp -55.91 -45.48 78.67 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.249 0.22 . . . . 0.0 110.677 -178.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.21 -40.79 96.81 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 110.709 -0.108 . . . . 0.0 110.709 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t -66.28 -46.3 87.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -61.63 -40.69 95.78 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -64.68 -57.28 9.46 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.587 0.355 . . . . 0.0 110.365 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -90.15 -79.11 0.35 Allowed 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.364 0.265 . . . . 0.0 110.371 -177.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 150.3 174.77 21.77 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 52.2 p -83.83 48.96 1.52 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -90.45 -134.11 0.12 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.9 107.7 0.89 Allowed 'General case' 0 C--N 1.344 0.334 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -65.87 -13.84 60.36 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.961 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -38.26 88.43 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 93.7 t -61.52 -49.99 82.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 75.2 mt -63.11 -42.57 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.43 -39.72 88.49 Favored 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -59.12 -36.95 76.07 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -79.7 -20.24 46.99 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.747 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.3 mt -118.01 85.51 23.68 Favored Pre-proline 0 C--N 1.345 0.381 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -54.94 152.42 29.43 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 122.189 1.926 . . . . 0.0 110.392 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 76.96 -44.6 0.47 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.737 0.815 . . . . 0.0 110.132 -178.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 -79.8 92.61 5.48 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.4 p -62.96 169.1 3.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.152 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -58.27 -35.4 71.73 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 66.0 t -63.58 -48.37 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -60.47 -49.39 77.76 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 91.8 m -59.62 -51.21 70.8 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -57.1 -56.3 23.56 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.41 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -55.22 -55.8 27.16 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -49.94 -40.01 42.23 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.731 -0.176 . . . . 0.0 110.646 -177.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -84.91 -75.55 0.35 Allowed 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.547 -178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -52.33 -33.71 43.96 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -174.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 52.1 tttt -86.36 -14.78 42.47 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.196 0.453 . . . . 0.0 111.69 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 4.6 t -134.88 -75.08 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 118.486 0.584 . . . . 0.0 110.638 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -72.75 99.66 2.67 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 118.318 0.508 . . . . 0.0 109.72 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -153.75 79.7 5.23 Favored Pre-proline 0 N--CA 1.452 -0.329 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -66.21 101.39 0.5 Allowed 'Trans proline' 0 N--CA 1.446 -1.278 0 C-N-CA 122.549 2.166 . . . . 0.0 109.279 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -155.04 148.48 25.15 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -177.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.148 0 CA-C-N 116.806 -0.179 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -177.83 63.25 0.09 OUTLIER Glycine 0 CA--C 1.524 0.637 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -55.95 112.96 1.32 Allowed 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 37.8 p 45.61 40.25 5.8 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.265 0.626 . . . . 0.0 110.59 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.6 ttt85 -56.78 135.37 55.47 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 31.4 m95 -96.29 156.43 16.34 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 74.3 p -130.36 154.57 47.54 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.9 ttt-85 -57.01 -38.71 73.49 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 -178.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.13 -36.63 75.56 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -77.28 -40.3 45.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -57.52 -36.75 71.98 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -61.9 -41.62 98.11 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 178.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -64.46 -48.75 74.08 Favored 'General case' 0 C--N 1.341 0.2 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 65.1 tp -58.0 -46.75 84.72 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.6 ttmt -56.27 -52.96 62.56 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 57.5 tttp -55.91 -45.48 78.67 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.249 0.22 . . . . 0.0 110.677 -178.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.21 -40.79 96.81 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 110.709 -0.108 . . . . 0.0 110.709 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t -66.28 -46.3 87.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -61.63 -40.69 95.78 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -64.68 -57.28 9.46 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.587 0.355 . . . . 0.0 110.365 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -90.15 -79.11 0.35 Allowed 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.364 0.265 . . . . 0.0 110.371 -177.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 150.3 174.77 21.77 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 52.2 p -83.83 48.96 1.52 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -90.45 -134.11 0.12 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.9 107.7 0.89 Allowed 'General case' 0 C--N 1.344 0.334 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -65.87 -13.84 60.36 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.961 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -38.26 88.43 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 93.7 t -61.52 -49.99 82.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 75.2 mt -63.11 -42.57 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.43 -39.72 88.49 Favored 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -59.12 -36.95 76.07 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -79.7 -20.24 46.99 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.747 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.3 mt -118.01 85.51 23.68 Favored Pre-proline 0 C--N 1.345 0.381 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -54.94 152.42 29.43 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 122.189 1.926 . . . . 0.0 110.392 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 76.96 -44.6 0.47 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.737 0.815 . . . . 0.0 110.132 -178.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 -79.8 92.61 5.48 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.4 p -62.96 169.1 3.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.152 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -58.27 -35.4 71.73 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 66.0 t -63.58 -48.37 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -60.47 -49.39 77.76 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 91.8 m -59.62 -51.21 70.8 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -57.1 -56.3 23.56 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.41 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -55.22 -55.8 27.16 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -179.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -49.94 -40.01 42.23 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.731 -0.176 . . . . 0.0 110.646 -177.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -84.91 -75.55 0.35 Allowed 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.547 -178.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -52.33 -33.71 43.96 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -174.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 52.1 tttt -86.36 -14.78 42.47 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.196 0.453 . . . . 0.0 111.69 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 4.6 t -134.88 -75.08 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 118.486 0.584 . . . . 0.0 110.638 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -72.75 99.66 2.67 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 118.318 0.508 . . . . 0.0 109.72 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -153.75 79.7 5.23 Favored Pre-proline 0 N--CA 1.452 -0.329 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -66.21 101.39 0.5 Allowed 'Trans proline' 0 N--CA 1.446 -1.278 0 C-N-CA 122.549 2.166 . . . . 0.0 109.279 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -155.04 148.48 25.15 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -177.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.148 0 CA-C-N 116.806 -0.179 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -177.83 63.25 0.09 OUTLIER Glycine 0 CA--C 1.524 0.637 0 N-CA-C 109.905 -1.278 . . . . 0.0 109.905 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -55.95 112.96 1.32 Allowed 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 37.8 p 45.61 40.25 5.8 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.265 0.626 . . . . 0.0 110.59 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 50.6 ttt85 -56.78 135.37 55.47 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 31.4 m95 -96.29 156.43 16.34 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 74.3 p -130.36 154.57 47.54 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.9 ttt-85 -57.01 -38.71 73.49 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 -178.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.13 -36.63 75.56 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -77.28 -40.3 45.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -57.52 -36.75 71.98 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -61.9 -41.62 98.11 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 178.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -64.46 -48.75 74.08 Favored 'General case' 0 C--N 1.341 0.2 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 65.1 tp -58.0 -46.75 84.72 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.6 ttmt -56.27 -52.96 62.56 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 57.5 tttp -55.91 -45.48 78.67 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.249 0.22 . . . . 0.0 110.677 -178.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.21 -40.79 96.81 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 110.709 -0.108 . . . . 0.0 110.709 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t -66.28 -46.3 87.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -61.63 -40.69 95.78 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -64.68 -57.28 9.46 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.587 0.355 . . . . 0.0 110.365 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.9 m-80 -90.15 -79.11 0.35 Allowed 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 122.364 0.265 . . . . 0.0 110.371 -177.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 150.3 174.77 21.77 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 52.2 p -83.83 48.96 1.52 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -90.45 -134.11 0.12 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.9 107.7 0.89 Allowed 'General case' 0 C--N 1.344 0.334 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -65.87 -13.84 60.36 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.961 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -38.26 88.43 Favored 'General case' 0 C--N 1.342 0.246 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 93.7 t -61.52 -49.99 82.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 75.2 mt -63.11 -42.57 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.43 -39.72 88.49 Favored 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -59.12 -36.95 76.07 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -79.7 -20.24 46.99 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.747 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.3 mt -118.01 85.51 23.68 Favored Pre-proline 0 C--N 1.345 0.381 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -54.94 152.42 29.43 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 122.189 1.926 . . . . 0.0 110.392 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 76.96 -44.6 0.47 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.737 0.815 . . . . 0.0 110.132 -178.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 -79.8 92.61 5.48 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.4 p -62.96 169.1 3.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.152 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -58.27 -35.4 71.73 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 66.0 t -63.58 -48.37 87.14 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -60.47 -49.39 77.76 Favored 'General case' 0 C--N 1.342 0.271 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 91.8 m -59.62 -51.21 70.8 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -57.1 -56.3 23.56 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.41 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -55.22 -55.8 27.16 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -179.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -49.94 -40.01 42.23 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 119.731 -0.176 . . . . 0.0 110.646 -177.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 61.1 t-105 -84.91 -75.55 0.35 Allowed 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.547 -178.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -52.33 -33.71 43.96 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -174.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 52.1 tttt -86.36 -14.78 42.47 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.196 0.453 . . . . 0.0 111.69 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 4.6 t -134.88 -75.08 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 118.486 0.584 . . . . 0.0 110.638 -179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -72.75 99.66 2.67 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 118.318 0.508 . . . . 0.0 109.72 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -153.75 79.7 5.23 Favored Pre-proline 0 N--CA 1.452 -0.329 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -66.21 101.39 0.5 Allowed 'Trans proline' 0 N--CA 1.446 -1.278 0 C-N-CA 122.549 2.166 . . . . 0.0 109.279 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -155.04 148.48 25.15 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -177.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.148 0 CA-C-N 116.806 -0.179 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_